BDBM50165598 CHEMBL3797857

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

InChI Key: InChIKey=DVBPDCTXXKIINT-FQLXRVMXSA-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 = 50165598   

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
Ghrelin receptor (Homo sapiens (Human))	BDBM50165598 (CHEMBL3797857) Show SMILES COc1ccc(Cn2c(nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)[C@@H](Cc2ccccc2)NC=O)cc1 |r| Show InChI InChI=1S/C33H37N7O3/c1-33(2,34)32(42)37-29(18-24-19-35-27-12-8-7-11-26(24)27)31-39-38-30(28(36-21-41)17-22-9-5-4-6-10-22)40(31)20-23-13-15-25(43-3)16-14-23/h4-16,19,21,28-29,35H,17-18,20,34H2,1-3H3,(H,36,41)(H,37,42)/t28-,29-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	59	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
Ghrelin receptor (Homo sapiens (Human))	BDBM50165598 (CHEMBL3797857) Show SMILES COc1ccc(Cn2c(nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)[C@@H](Cc2ccccc2)NC=O)cc1 |r| Show InChI InChI=1S/C33H37N7O3/c1-33(2,34)32(42)37-29(18-24-19-35-27-12-8-7-11-26(24)27)31-39-38-30(28(36-21-41)17-22-9-5-4-6-10-22)40(31)20-23-13-15-25(43-3)16-14-23/h4-16,19,21,28-29,35H,17-18,20,34H2,1-3H3,(H,36,41)(H,37,42)/t28-,29-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	113	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
Ghrelin receptor (Homo sapiens (Human))	BDBM50165598 (CHEMBL3797857) Show SMILES COc1ccc(Cn2c(nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)N)[C@@H](Cc2ccccc2)NC=O)cc1 |r| Show InChI InChI=1S/C33H37N7O3/c1-33(2,34)32(42)37-29(18-24-19-35-27-12-8-7-11-26(24)27)31-39-38-30(28(36-21-41)17-22-9-5-4-6-10-22)40(31)20-23-13-15-25(43-3)16-14-23/h4-16,19,21,28-29,35H,17-18,20,34H2,1-3H3,(H,36,41)(H,37,42)/t28-,29-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	43	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