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Name | Bombesin receptor subtype-3 |
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Species | Homo sapiens (Human) |
Gene | BRS3 |
Synonym | bombesin receptor subtype-3 BRS-3 bombesin like receptor 3 BB3 receptor bb3 |
Disease | Breast cancer Cancer |
Length | 399 |
Amino acid sequence | MAQRQPHSPNQTLISITNDTESSSSVVSNDNTNKGWSGDNSPGIEALCAIYITYAVIISVGILGNAILIKVFFKTKSMQTVPNIFITSLAFGDLLLLLTCVPVDATHYLAEGWLFGRIGCKVLSFIRLTSVGVSVFTLTILSADRYKAVVKPLERQPSNAILKTCVKAGCVWIVSMIFALPEAIFSNVYTFRDPNKNMTFESCTSYPVSKKLLQEIHSLLCFLVFYIIPLSIISVYYSLIARTLYKSTLNIPTEEQSHARKQIESRKRIARTVLVLVALFALCWLPNHLLYLYHSFTSQTYVDPSAMHFIFTIFSRVLAFSNSCVNPFALYWLSKSFQKHFKAQLFCCKAERPEPPVADTSLTTLAVMGTVPGTGSIQMSEISVTSFTGCSVKQAEDRF |
UniProt | P32247 |
Protein Data Bank | N/A |
GPCR-HGmod model | P32247 |
3D structure model | This predicted structure model is from GPCR-EXP P32247. |
BioLiP | N/A |
Therapeutic Target Database | T68887 |
ChEMBL | CHEMBL4080 |
IUPHAR | 40 |
DrugBank | N/A |
Name | CHEMBL1089521 |
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Molecular formula | C20H26N4 |
IUPAC name | 5-(2,2-dimethylbutyl)-2-[2-(4-pyrazol-1-ylphenyl)ethyl]-1H-imidazole |
Molecular weight | 322.456 |
Hydrogen bond acceptor | 2 |
Hydrogen bond donor | 1 |
XlogP | 4.8 |
Synonyms | 1-(4-(2-(4-(2,2-dimethylbutyl)-1H-imidazol-2-yl)ethyl)phenyl)-1H-pyrazole BDBM50314981 SCHEMBL3517495 |
Inchi Key | IHPQVRDFFGMWRN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H26N4/c1-4-20(2,3)14-17-15-21-19(23-17)11-8-16-6-9-18(10-7-16)24-13-5-12-22-24/h5-7,9-10,12-13,15H,4,8,11,14H2,1-3H3,(H,21,23) |
PubChem CID | 25025862 |
ChEMBL | CHEMBL1089521 |
IUPHAR | N/A |
BindingDB | 50314981 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
EC50 | 106.0 nM | PMID20219372 | BindingDB,ChEMBL |
EC50 | 135.0 nM | PMID20219372 | BindingDB,ChEMBL |
IC50 | 33.0 nM | PMID20219372 | BindingDB,ChEMBL |
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