BDBM50213661 (S)-1-(2-(3,5-dimethylphenyl)-3-(1-(2-(pyridin-4-yl)ethylamino)propan-2-yl)-6,7-dihydro-1H-pyrrolo[3,2-c]pyridin-5(4H)-yl)-2-(2-methoxyphenyl)ethanone::CHEMBL232356

SMILES: COc1ccccc1CC(=O)N1CCc2[nH]c(c([C@H](C)CNCCc3ccncc3)c2C1)-c1cc(C)cc(C)c1

InChI Key: InChIKey=YQGOJCRMFSLKNW-RUZDIDTESA-N

Data: 1 KI  1 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 2 hits for monomerid = 50213661   

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
Gonadotropin-releasing hormone receptor (Rattus norvegicus)	BDBM50213661 ((S)-1-(2-(3,5-dimethylphenyl)-3-(1-(2-(pyridin-4-y...) Show SMILES COc1ccccc1CC(=O)N1CCc2[nH]c(c([C@H](C)CNCCc3ccncc3)c2C1)-c1cc(C)cc(C)c1 Show InChI InChI=1S/C34H40N4O2/c1-23-17-24(2)19-28(18-23)34-33(25(3)21-36-15-11-26-9-13-35-14-10-26)29-22-38(16-12-30(29)37-34)32(39)20-27-7-5-6-8-31(27)40-4/h5-10,13-14,17-19,25,36-37H,11-12,15-16,20-22H2,1-4H3/t25-/m1/s1	KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	5.60	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Displacement of [125I]-Tyr5, DLeu6, NMeLeu7, Pro-N-Et-GnRH from cloned rat GnRHR				Bioorg Med Chem Lett 17: 3845-50 (2007) Article DOI: 10.1016/j.bmcl.2007.05.009 BindingDB Entry DOI: 10.7270/Q2JD4WHQ
					More data for this Ligand-Target Pair
Gonadotropin-releasing hormone receptor (Homo sapiens (Human))	BDBM50213661 ((S)-1-(2-(3,5-dimethylphenyl)-3-(1-(2-(pyridin-4-y...) Show SMILES COc1ccccc1CC(=O)N1CCc2[nH]c(c([C@H](C)CNCCc3ccncc3)c2C1)-c1cc(C)cc(C)c1 Show InChI InChI=1S/C34H40N4O2/c1-23-17-24(2)19-28(18-23)34-33(25(3)21-36-15-11-26-9-13-35-14-10-26)29-22-38(16-12-30(29)37-34)32(39)20-27-7-5-6-8-31(27)40-4/h5-10,13-14,17-19,25,36-37H,11-12,15-16,20-22H2,1-4H3/t25-/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	462	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences, Inc. Curated by ChEMBL					Assay Description Inhibition of human GnRHR expressed in RBL cells assessed as inhibition of GnRH-stimulated [3H]-inositol phosphate hydrolysis				Bioorg Med Chem Lett 17: 3845-50 (2007) Article DOI: 10.1016/j.bmcl.2007.05.009 BindingDB Entry DOI: 10.7270/Q2JD4WHQ
					More data for this Ligand-Target Pair