CHEMBL403317
SMILES | CSCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CN)[C@@H](C)O)C(N)=O |
InChIKey | YPFNACALNKVZNK-MFNIMNRCSA-N |
Chemical properties
Hydrogen bond acceptors | None |
Hydrogen bond donors | None |
Rotatable bonds | None |
Molecular weight (Da) |
Drug properties
Molecular type | Protein |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
BB1 | NMBR | Human | Bombesin | A | pKi | 10.17 | 10.17 | 10.17 | ChEMBL |
BB2 | GRPR | Human | Bombesin | A | pKi | 7.25 | 7.25 | 7.25 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
BB1 | NMBR | Rat | Bombesin | A | pIC50 | 9.15 | 9.15 | 9.15 | ChEMBL |
BB1 | NMBR | Human | Bombesin | A | pEC50 | 6.92 | 6.92 | 6.92 | ChEMBL |
BB2 | GRPR | Human | Bombesin | A | pEC50 | 7.39 | 7.39 | 7.39 | ChEMBL |
BB3 | BRS3 | Human | Bombesin | A | pEC50 | 5.35 | 5.35 | 5.35 | ChEMBL |