genistein
SMILES | Oc1ccc(cc1)c1coc2c(c1=O)c(O)cc(c2)O |
InChIKey | TZBJGXHYKVUXJN-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 3 |
Rotatable bonds | 1 |
Molecular weight (Da) | 270.1 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | Yes |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
A2A | AA2AR | Rat | Adenosine | A | pKi | 4.44 | 4.44 | 4.44 | ChEMBL |
A1 | AA1R | Rat | Adenosine | A | pKi | 5.3 | 5.3 | 5.3 | ChEMBL |
5-HT2C | 5HT2C | Human | 5-Hydroxytryptamine | A | pKi | 5.11 | 5.11 | 5.11 | ChEMBL |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pKi | 5.52 | 5.52 | 5.52 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 5.01 | 5.01 | 5.01 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 4.93 | 4.93 | 4.93 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
TAS2R14 | T2R14 | Human | Taste 2 | T2 | pEC50 | 4.19 | 4.19 | 4.19 | Guide to Pharmacology |
TAS2R39 | T2R39 | Human | Taste 2 | T2 | pEC50 | 4.31 | 4.31 | 4.31 | Guide to Pharmacology |
5-HT2C | 5HT2C | Human | 5-Hydroxytryptamine | A | pIC50 | 4.83 | 4.83 | 4.83 | ChEMBL |
5-HT2A | 5HT2A | Human | 5-Hydroxytryptamine | A | pIC50 | 4.98 | 4.98 | 4.98 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pIC50 | 4.76 | 4.76 | 4.76 | ChEMBL |
TSH | TSHR | Human | Glycoprotein hormone | A | Potency | 6.0 | 6.0 | 6.0 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pIC50 | 4.7 | 4.7 | 4.7 | ChEMBL |