BDBM50165597 CHEMBL3800225

SMILES: COc1ccc(Cn2c(nnc2[C@H](Cc2ccccc2)NC(C)=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1

InChI Key: InChIKey=RFENXHFGTAFVTC-XZWHSSHBSA-N

Data: 1 KI  2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50165597   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Growth hormone secretagogue receptor type 1 (Homo sapiens (Human))	BDBM50165597 (CHEMBL3800225) Show SMILES COc1ccc(Cn2c(nnc2[C@H](Cc2ccccc2)NC(C)=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1 |r| Show InChI InChI=1S/C34H39N7O3/c1-22(42)37-29(18-23-10-6-5-7-11-23)31-39-40-32(41(31)21-24-14-16-26(44-4)17-15-24)30(38-33(43)34(2,3)35)19-25-20-36-28-13-9-8-12-27(25)28/h5-17,20,29-30,36H,18-19,21,35H2,1-4H3,(H,37,42)(H,38,43)/t29-,30+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Montpellier Curated by ChEMBL					Assay Description Displacement of [125I]-His9-ghrelin from human GHS-R1a transfected in pig LLC PK-1 cell membranes after 60 mins by gamma counting method				Bioorg Med Chem Lett 26: 2408-12 (2016) Article DOI: 10.1016/j.bmcl.2016.04.003 BindingDB Entry DOI: 10.7270/Q2J9688V
					More data for this Ligand-Target Pair
Growth hormone secretagogue receptor type 1 (Homo sapiens (Human))	BDBM50165597 (CHEMBL3800225) Show SMILES COc1ccc(Cn2c(nnc2[C@H](Cc2ccccc2)NC(C)=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1 |r| Show InChI InChI=1S/C34H39N7O3/c1-22(42)37-29(18-23-10-6-5-7-11-23)31-39-40-32(41(31)21-24-14-16-26(44-4)17-15-24)30(38-33(43)34(2,3)35)19-25-20-36-28-13-9-8-12-27(25)28/h5-17,20,29-30,36H,18-19,21,35H2,1-4H3,(H,37,42)(H,38,43)/t29-,30+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Montpellier Curated by ChEMBL					Assay Description Antagonist activity at human GHS-R1a transfected in mouse LTK cells after 6 hrs by CRE/luciferase reporter gene assay in presence of ghrelin and roli...				Bioorg Med Chem Lett 26: 2408-12 (2016) Article DOI: 10.1016/j.bmcl.2016.04.003 BindingDB Entry DOI: 10.7270/Q2J9688V
					More data for this Ligand-Target Pair
Growth hormone secretagogue receptor type 1 (Homo sapiens (Human))	BDBM50165597 (CHEMBL3800225) Show SMILES COc1ccc(Cn2c(nnc2[C@H](Cc2ccccc2)NC(C)=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)cc1 |r| Show InChI InChI=1S/C34H39N7O3/c1-22(42)37-29(18-23-10-6-5-7-11-23)31-39-40-32(41(31)21-24-14-16-26(44-4)17-15-24)30(38-33(43)34(2,3)35)19-25-20-36-28-13-9-8-12-27(25)28/h5-17,20,29-30,36H,18-19,21,35H2,1-4H3,(H,37,42)(H,38,43)/t29-,30+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Montpellier Curated by ChEMBL					Assay Description Antagonist activity at human GHS-R1a transfected in CHO cells assessed as inhibition of ghrelin-induced intracellular calcium mobilization measured o...				Bioorg Med Chem Lett 26: 2408-12 (2016) Article DOI: 10.1016/j.bmcl.2016.04.003 BindingDB Entry DOI: 10.7270/Q2J9688V
					More data for this Ligand-Target Pair