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P30550 | GRPR_HUMAN | Gastrin-releasing peptide receptor (GRPR)

3D structures mapped by conservation among orthologs



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL312926 OBDepict CH 3 O N H O N H H 3 C N H O N H + N O _ O Ki = 3.7 nM 583.69 COc1ccc(C2(CNC(=O)[C@](C)(Cc3c[nH]c4ccccc34)NC(=O)Nc3ccc([N+](=O)[O-])cc3)CCCCC2)cc1 Homo sapiens CHEMBL650353 single protein format
CHEMBL85291 OBDepict CH 3 O N H O N H CH 3 N H O N H + N O _ O Ki = 5.8 nM 597.72 CCOc1ccc(C2(CNC(=O)[C@](C)(Cc3c[nH]c4ccccc34)NC(=O)Nc3ccc([N+](=O)[O-])cc3)CCCCC2)cc1 Homo sapiens CHEMBL650353 single protein format
CHEMBL327388 OBDepict O NH N H H 3 C N H O N + N H O _ O + N O _ O Ki = 6.4 nM 598.66 C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(c2ccc([N+](=O)[O-])cc2)CCCCC1 Homo sapiens CHEMBL650353 single protein format
CHEMBL433143 OBDepict O HN HN CH 3 HN O N + N H O _ O N CH 3 H 3 C Ki = 9.0 nM 596.73 CN(C)c1ccc(C2(CNC(=O)[C@](C)(Cc3c[nH]c4ccccc34)NC(=O)Nc3ccc([N+](=O)[O-])cc3)CCCCC2)cc1 Homo sapiens CHEMBL650353 single protein format
CHEMBL405908 OBDepict CH 3 O N N H O N H H 3 C N H O N H + N O _ O IC50 = 16.0 nM 584.68 COc1ccc(C2(CNC(=O)[C@](C)(Cc3c[nH]c4ccccc34)NC(=O)Nc3ccc([N+](=O)[O-])cc3)CCCCC2)nc1 Homo sapiens CHEMBL883283 tissue-based format
CHEMBL329650 OBDepict O NH N H H 3 C N H O N + N H O _ O N Ki = 17.0 nM 554.65 C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(c2ccccn2)CCCCC1 Homo sapiens CHEMBL650353 single protein format
CHEMBL87846 OBDepict O NH N H H 3 C N H O N + N H O _ O OH Ki = 32.0 nM 569.66 C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(c2ccc(O)cc2)CCCCC1 Homo sapiens CHEMBL650353 single protein format
CHEMBL313030 OBDepict O HN HN CH 3 HN O N + N H O _ O CH 3 H 3 C Ki = 35.0 nM 595.74 CC(C)c1ccc(C2(CNC(=O)[C@](C)(Cc3c[nH]c4ccccc34)NC(=O)Nc3ccc([N+](=O)[O-])cc3)CCCCC2)cc1 Homo sapiens CHEMBL650353 single protein format
CHEMBL327840 OBDepict N HN HN O CH 3 N H O N H N Ki = 37.0 nM 534.66 C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)Nc1ccc(C#N)cc1)C(=O)NCC1(c2ccccn2)CCCCC1 Homo sapiens CHEMBL650353 single protein format
CHEMBL327678 OBDepict O NH N H H 3 C N H O Cl N Cl H N Ki = 85.0 nM 578.54 C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)Nc1ccc(Cl)c(Cl)c1)C(=O)NCC1(c2ccccn2)CCCCC1 Homo sapiens CHEMBL650353 single protein format
CHEMBL313346 OBDepict O NH N H H 3 C N H O + N N O _ O H N Ki = 85.0 nM 554.65 C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)NCC1(c2ccccn2)CCCCC1 Homo sapiens CHEMBL650353 single protein format
CHEMBL86370 OBDepict O NH N H H 3 C N H O N + N H O _ O Ki = 89.0 nM 553.66 C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(c2ccccc2)CCCCC1 Homo sapiens CHEMBL650353 single protein format
CHEMBL90614 OBDepict O NH N H H 3 C N H O N H F F F N Ki = 124.0 nM 577.65 C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)Nc1ccc(C(F)(F)F)cc1)C(=O)NCC1(c2ccccn2)CCCCC1 Homo sapiens CHEMBL650353 single protein format
CHEMBL316085 OBDepict O NH N H H 3 C N H O N Cl H N Ki = 149.0 nM 544.1 C[C@@](Cc1c[nH]c2ccccc12)(NC(=O)Nc1ccc(Cl)cc1)C(=O)NCC1(c2ccccn2)CCCCC1 Homo sapiens CHEMBL650353 single protein format
CHEMBL88010 OBDepict O NH NH H 3 C NH O N H H 3 C CH 3 N Ki = 273.0 nM 551.74 CC(C)c1ccc(NC(=O)N[C@@](C)(Cc2c[nH]c3ccccc23)C(=O)NCC2(c3ccccn3)CCCCC2)cc1 Homo sapiens CHEMBL650353 single protein format
CHEMBL89734 OBDepict CH 3 O N H O N H H 3 C N H O N H + N O _ O Ki = 404.0 nM 583.69 COc1ccccc1C1(CNC(=O)[C@](C)(Cc2c[nH]c3ccccc23)NC(=O)Nc2ccc([N+](=O)[O-])cc2)CCCCC1 Homo sapiens CHEMBL650353 single protein format