Ligand source activities (1 row/activity)
Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | ||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sel. page | Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
AssayType |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
136036237 | 195418 | 0 | None | -3 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 632 | 7 | 3 | 6 | 5.9 | CCC(C)[C@H]1C(=O)Nc2ccc(N3CCC(NC(C)=O)C3)cc2-c2nc3cc(C(=O)NCc4cccc(C(F)(F)F)c4)ccc3n21 | 10.1016/j.bmcl.2009.01.085 | ||
CHEMBL503202 | 195418 | 0 | None | -3 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 632 | 7 | 3 | 6 | 5.9 | CCC(C)[C@H]1C(=O)Nc2ccc(N3CCC(NC(C)=O)C3)cc2-c2nc3cc(C(=O)NCc4cccc(C(F)(F)F)c4)ccc3n21 | 10.1016/j.bmcl.2009.01.085 | ||
136036259 | 195442 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 550 | 6 | 2 | 6 | 5.6 | CC(C)[C@H]1C(=O)Nc2ccc(NCc3ccccc3)cc2-c2nc3cc(C(=O)N(C)C4CCN(C)CC4)ccc3n21 | 10.1016/j.bmcl.2009.01.085 | ||
CHEMBL503688 | 195442 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 550 | 6 | 2 | 6 | 5.6 | CC(C)[C@H]1C(=O)Nc2ccc(NCc3ccccc3)cc2-c2nc3cc(C(=O)N(C)C4CCN(C)CC4)ccc3n21 | 10.1016/j.bmcl.2009.01.085 | ||
136036261 | 195531 | 0 | None | -10 | 2 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 632 | 9 | 3 | 6 | 7.1 | CCC(C)[C@H]1C(=O)Nc2ccc(NCCN3CCCCC3)cc2-c2nc3cc(C(=O)NCc4cccc(C(F)(F)F)c4)ccc3n21 | 10.1016/j.bmcl.2009.01.085 | ||
CHEMBL505263 | 195531 | 0 | None | -10 | 2 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 632 | 9 | 3 | 6 | 7.1 | CCC(C)[C@H]1C(=O)Nc2ccc(NCCN3CCCCC3)cc2-c2nc3cc(C(=O)NCc4cccc(C(F)(F)F)c4)ccc3n21 | 10.1016/j.bmcl.2009.01.085 | ||
135407952 | 7846 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 542 | 4 | 2 | 6 | 5.8 | CN1CCCN(CC1)C(=O)c1ccc2c(c1)nc1n2[C@@H](C(C)C)C(=O)Nc2c1cc(cc2)NC1CCCCCC1 | 10.1016/j.bmcl.2009.01.085 | ||
5530 | 7846 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 542 | 4 | 2 | 6 | 5.8 | CN1CCCN(CC1)C(=O)c1ccc2c(c1)nc1n2[C@@H](C(C)C)C(=O)Nc2c1cc(cc2)NC1CCCCCC1 | 10.1016/j.bmcl.2009.01.085 | ||
CHEMBL463274 | 7846 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 542 | 4 | 2 | 6 | 5.8 | CN1CCCN(CC1)C(=O)c1ccc2c(c1)nc1n2[C@@H](C(C)C)C(=O)Nc2c1cc(cc2)NC1CCCCCC1 | 10.1016/j.bmcl.2009.01.085 | ||
135869412 | 195222 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 619 | 6 | 1 | 7 | 5.3 | CC(C)[C@H]1C(=O)Nc2ccc(N3CCN(Cc4ccccc4)CC3)cc2-c2nc3cc(C(=O)N(C)C4CCN(C)CC4)ccc3n21 | 10.1016/j.bmcl.2009.01.085 | ||
CHEMBL502480 | 195222 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 619 | 6 | 1 | 7 | 5.3 | CC(C)[C@H]1C(=O)Nc2ccc(N3CCN(Cc4ccccc4)CC3)cc2-c2nc3cc(C(=O)N(C)C4CCN(C)CC4)ccc3n21 | 10.1016/j.bmcl.2009.01.085 | ||
CHEMBL2448526 | 217279 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | None | None | None | C[C@@H](O)[C@@H]1NC(=O)[C@@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H]2CCCN2)CSSC[C@@H](C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](Cc2ccccc2)NC1=O | 10.1016/j.bmcl.2009.01.085 | ||||
135407930 | 195199 | 0 | None | -10 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 606 | 10 | 3 | 6 | 6.6 | CCC(C)[C@H]1C(=O)Nc2ccc(NCCCN(C)C)cc2-c2nc3cc(C(=O)NCc4cccc(C(F)(F)F)c4)ccc3n21 | 10.1016/j.bmcl.2009.01.085 | ||
CHEMBL502132 | 195199 | 0 | None | -10 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 606 | 10 | 3 | 6 | 6.6 | CCC(C)[C@H]1C(=O)Nc2ccc(NCCCN(C)C)cc2-c2nc3cc(C(=O)NCc4cccc(C(F)(F)F)c4)ccc3n21 | 10.1016/j.bmcl.2009.01.085 | ||
164734529 | 197618 | 3 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 491 | 6 | 1 | 6 | 3.6 | C[C@@H](C(=O)Nc1cnc(Oc2ccc(F)cc2F)cn1)N1CCC(F)(F)[C@@H](c2cc[n+]([O-])cc2)C1 | 10.1021/acsmedchemlett.2c00262 | ||
CHEMBL5184300 | 197618 | 3 | None | - | 1 | Human | 8.6 | pIC50 | = | 8.6 | Functional | ChEMBL | 491 | 6 | 1 | 6 | 3.6 | C[C@@H](C(=O)Nc1cnc(Oc2ccc(F)cc2F)cn1)N1CCC(F)(F)[C@@H](c2cc[n+]([O-])cc2)C1 | 10.1021/acsmedchemlett.2c00262 | ||
9567 | 10522 | 9 | None | -1819 | 3 | Human | 5.7 | pEC50 | = | 5.7 | Functional | Guide to Pharmacology | 344 | 1 | 1 | 3 | 3.9 | CN1CC[C@]2([C@H](C1)Cc1c(C2)nc2c(c1)cccc2)c1cccc(c1)O | 11765135 | ||
9567 | 10522 | 9 | None | -1819 | 3 | Human | 5.7 | pEC50 | = | 5.7 | Functional | Guide to Pharmacology | 344 | 1 | 1 | 3 | 3.9 | CN1CC[C@]2([C@H](C1)Cc1c(C2)nc2c(c1)cccc2)c1cccc(c1)O | 23396314 | ||
9567 | 10522 | 9 | None | -1819 | 3 | Human | 5.7 | pEC50 | = | 5.7 | Functional | Guide to Pharmacology | 344 | 1 | 1 | 3 | 3.9 | CN1CC[C@]2([C@H](C1)Cc1c(C2)nc2c(c1)cccc2)c1cccc(c1)O | 28288109 | ||
9950038 | 10522 | 9 | None | -1819 | 3 | Human | 5.7 | pEC50 | = | 5.7 | Functional | Guide to Pharmacology | 344 | 1 | 1 | 3 | 3.9 | CN1CC[C@]2([C@H](C1)Cc1c(C2)nc2c(c1)cccc2)c1cccc(c1)O | 11765135 | ||
9950038 | 10522 | 9 | None | -1819 | 3 | Human | 5.7 | pEC50 | = | 5.7 | Functional | Guide to Pharmacology | 344 | 1 | 1 | 3 | 3.9 | CN1CC[C@]2([C@H](C1)Cc1c(C2)nc2c(c1)cccc2)c1cccc(c1)O | 23396314 | ||
9950038 | 10522 | 9 | None | -1819 | 3 | Human | 5.7 | pEC50 | = | 5.7 | Functional | Guide to Pharmacology | 344 | 1 | 1 | 3 | 3.9 | CN1CC[C@]2([C@H](C1)Cc1c(C2)nc2c(c1)cccc2)c1cccc(c1)O | 28288109 | ||
CHEMBL327745 | 10522 | 9 | None | -1819 | 3 | Human | 5.7 | pEC50 | = | 5.7 | Functional | Guide to Pharmacology | 344 | 1 | 1 | 3 | 3.9 | CN1CC[C@]2([C@H](C1)Cc1c(C2)nc2c(c1)cccc2)c1cccc(c1)O | 11765135 | ||
CHEMBL327745 | 10522 | 9 | None | -1819 | 3 | Human | 5.7 | pEC50 | = | 5.7 | Functional | Guide to Pharmacology | 344 | 1 | 1 | 3 | 3.9 | CN1CC[C@]2([C@H](C1)Cc1c(C2)nc2c(c1)cccc2)c1cccc(c1)O | 23396314 | ||
CHEMBL327745 | 10522 | 9 | None | -1819 | 3 | Human | 5.7 | pEC50 | = | 5.7 | Functional | Guide to Pharmacology | 344 | 1 | 1 | 3 | 3.9 | CN1CC[C@]2([C@H](C1)Cc1c(C2)nc2c(c1)cccc2)c1cccc(c1)O | 28288109 | ||
10567 | 8618 | 0 | None | -1 | 3 | Human | 5.7 | pEC50 | = | 5.7 | Functional | Guide to Pharmacology | None | None | None | None | 35704588 | ||||
145996510 | 8618 | 0 | None | -1 | 3 | Human | 5.7 | pEC50 | = | 5.7 | Functional | Guide to Pharmacology | None | None | None | None | 35704588 | ||||
2098 | 10466 | 36 | None | -2089 | 11 | Human | 6.0 | pEC50 | = | 6.0 | Functional | Guide to Pharmacology | None | None | None | None | 25517090 | ||||
2098 | 10466 | 36 | None | -2089 | 11 | Human | 6.0 | pEC50 | = | 6.0 | Functional | Guide to Pharmacology | None | None | None | None | 28288109 | ||||
36511 | 10466 | 36 | None | -2089 | 11 | Human | 6.0 | pEC50 | = | 6.0 | Functional | Guide to Pharmacology | None | None | None | None | 25517090 | ||||
36511 | 10466 | 36 | None | -2089 | 11 | Human | 6.0 | pEC50 | = | 6.0 | Functional | Guide to Pharmacology | None | None | None | None | 28288109 | ||||
3805 | 10466 | 36 | None | -2089 | 11 | Human | 6.0 | pEC50 | = | 6.0 | Functional | Guide to Pharmacology | None | None | None | None | 25517090 | ||||
3805 | 10466 | 36 | None | -2089 | 11 | Human | 6.0 | pEC50 | = | 6.0 | Functional | Guide to Pharmacology | None | None | None | None | 28288109 | ||||
3835 | 10466 | 36 | None | -2089 | 11 | Human | 6.0 | pEC50 | = | 6.0 | Functional | Guide to Pharmacology | None | None | None | None | 25517090 | ||||
3835 | 10466 | 36 | None | -2089 | 11 | Human | 6.0 | pEC50 | = | 6.0 | Functional | Guide to Pharmacology | None | None | None | None | 28288109 | ||||
CHEMBL235363 | 10466 | 36 | None | -2089 | 11 | Human | 6.0 | pEC50 | = | 6.0 | Functional | Guide to Pharmacology | None | None | None | None | 25517090 | ||||
CHEMBL235363 | 10466 | 36 | None | -2089 | 11 | Human | 6.0 | pEC50 | = | 6.0 | Functional | Guide to Pharmacology | None | None | None | None | 28288109 | ||||
16133849 | 10448 | 12 | None | -66069 | 4 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | None | None | None | None | 23396314 | ||||
2020 | 10448 | 12 | None | -66069 | 4 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | None | None | None | None | 23396314 | ||||
91935900 | 10448 | 12 | None | -66069 | 4 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | None | None | None | None | 23396314 | ||||
CHEMBL501796 | 10448 | 12 | None | -66069 | 4 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | None | None | None | None | 23396314 | ||||
12988 | 8361 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | 673 | 5 | 2 | 9 | 6.2 | NC1=C(C#N)C2=C(C=CC(F)=C2S1)C3=C(F)C4=NC(OC[C@@]56CCCN5C[C@H](F)C6)=NC(N7CC8CCC(C7)N8)=C4C=C3C(F)(F)F | 37321326 | ||
164904685 | 8361 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | 673 | 5 | 2 | 9 | 6.2 | NC1=C(C#N)C2=C(C=CC(F)=C2S1)C3=C(F)C4=NC(OC[C@@]56CCCN5C[C@H](F)C6)=NC(N7CC8CCC(C7)N8)=C4C=C3C(F)(F)F | 37321326 | ||
2855 | 7889 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | Guide to Pharmacology | 519 | 16 | 3 | 6 | 4.2 | CNCCc1cc(Cc2cc(CCNC)ccc2OC)c(c(c1)Cc1cc(CCNC)ccc1OC)OC | 28288109 | ||
5531 | 7889 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | Guide to Pharmacology | 519 | 16 | 3 | 6 | 4.2 | CNCCc1cc(Cc2cc(CCNC)ccc2OC)c(c(c1)Cc1cc(CCNC)ccc1OC)OC | 28288109 | ||
9566 | 10199 | 14 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | Guide to Pharmacology | 307 | 3 | 0 | 5 | 2.5 | CN([C@@H]1CCN(C1)c1cc(nc2n1ncc2)c1ccccc1)C | 28288109 | ||
95882507 | 10199 | 14 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | Guide to Pharmacology | 307 | 3 | 0 | 5 | 2.5 | CN([C@@H]1CCN(C1)c1cc(nc2n1ncc2)c1ccccc1)C | 28288109 | ||
CHEMBL4520293 | 10199 | 14 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | Guide to Pharmacology | 307 | 3 | 0 | 5 | 2.5 | CN([C@@H]1CCN(C1)c1cc(nc2n1ncc2)c1ccccc1)C | 28288109 | ||
135407952 | 7846 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | Guide to Pharmacology | 542 | 4 | 2 | 6 | 5.8 | CN1CCCN(CC1)C(=O)c1ccc2c(c1)nc1n2[C@@H](C(C)C)C(=O)Nc2c1cc(cc2)NC1CCCCCC1 | 19230660 | ||
5530 | 7846 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | Guide to Pharmacology | 542 | 4 | 2 | 6 | 5.8 | CN1CCCN(CC1)C(=O)c1ccc2c(c1)nc1n2[C@@H](C(C)C)C(=O)Nc2c1cc(cc2)NC1CCCCCC1 | 19230660 | ||
CHEMBL463274 | 7846 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | Guide to Pharmacology | 542 | 4 | 2 | 6 | 5.8 | CN1CCCN(CC1)C(=O)c1ccc2c(c1)nc1n2[C@@H](C(C)C)C(=O)Nc2c1cc(cc2)NC1CCCCCC1 | 19230660 | ||
2007 | 7953 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | Guide to Pharmacology | None | None | None | None | 12915402 | ||||
2007 | 7953 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | Guide to Pharmacology | None | None | None | None | 15823563 | ||||
2007 | 7953 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | Guide to Pharmacology | None | None | None | None | 23396314 | ||||
2007 | 7953 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | Guide to Pharmacology | None | None | None | None | 28288109 | ||||
4056 | 9772 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | Guide to Pharmacology | None | None | None | None | 15823563 |
Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | |||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Sel. page | Similar- ity |
Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
Assay Type |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
9566 | 10199 | 14 | None | - | 2 | Human | 6.0 | pEC50 | = | 6 | Binding | ChEMBL | 307 | 3 | 0 | 5 | 2.5 | CN([C@@H]1CCN(C1)c1cc(nc2n1ncc2)c1ccccc1)C | 10.6019/CHEMBL5212743 | |||
95882507 | 10199 | 14 | None | - | 2 | Human | 6.0 | pEC50 | = | 6 | Binding | ChEMBL | 307 | 3 | 0 | 5 | 2.5 | CN([C@@H]1CCN(C1)c1cc(nc2n1ncc2)c1ccccc1)C | 10.6019/CHEMBL5212743 | |||
CHEMBL4520293 | 10199 | 14 | None | - | 2 | Human | 6.0 | pEC50 | = | 6 | Binding | ChEMBL | 307 | 3 | 0 | 5 | 2.5 | CN([C@@H]1CCN(C1)c1cc(nc2n1ncc2)c1ccccc1)C | 10.6019/CHEMBL5212743 | |||
12074028 | 197665 | 0 | None | - | 0 | Human | 6.5 | pEC50 | = | 6.5 | Binding | ChEMBL | 344 | 1 | 1 | 3 | 3.9 | CN1CC[C@]2(c3cccc(O)c3)Cc3nc4ccccc4cc3C[C@@H]2C1 | 10.1016/j.bmcl.2021.128485 | |||
CHEMBL5184932 | 197665 | 0 | None | - | 0 | Human | 6.5 | pEC50 | = | 6.5 | Binding | ChEMBL | 344 | 1 | 1 | 3 | 3.9 | CN1CC[C@]2(c3cccc(O)c3)Cc3nc4ccccc4cc3C[C@@H]2C1 | 10.1016/j.bmcl.2021.128485 | |||
9566 | 10199 | 14 | None | - | 2 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 307 | 3 | 0 | 5 | 2.5 | CN([C@@H]1CCN(C1)c1cc(nc2n1ncc2)c1ccccc1)C | 10.6019/CHEMBL5210121 | |||
95882507 | 10199 | 14 | None | - | 2 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 307 | 3 | 0 | 5 | 2.5 | CN([C@@H]1CCN(C1)c1cc(nc2n1ncc2)c1ccccc1)C | 10.6019/CHEMBL5210121 | |||
CHEMBL4520293 | 10199 | 14 | None | - | 2 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 307 | 3 | 0 | 5 | 2.5 | CN([C@@H]1CCN(C1)c1cc(nc2n1ncc2)c1ccccc1)C | 10.6019/CHEMBL5210121 | |||
129072557 | 183985 | 6 | None | - | 0 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 763 | 9 | 5 | 10 | 3.1 | Cc1cc(C[C@@H](NC(=O)N2CCC3(CC2)OC(=O)Nc2ncccc23)C(=O)N[C@@H](CC2CCNCC2)C(=O)N2CCN(c3ccncc3)CC2)cc2cn[nH]c12 | 10.1021/acs.jmedchem.0c01003 | |||
CHEMBL4635331 | 183985 | 6 | None | - | 0 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 763 | 9 | 5 | 10 | 3.1 | Cc1cc(C[C@@H](NC(=O)N2CCC3(CC2)OC(=O)Nc2ncccc23)C(=O)N[C@@H](CC2CCNCC2)C(=O)N2CCN(c3ccncc3)CC2)cc2cn[nH]c12 | 10.1021/acs.jmedchem.0c01003 |