BDBM50206674 (S)-3-(6-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl)-N-methyl-N-((S)-1-(tetrahydro-2H-pyran-4-yl)pyrrolidin-3-yl)pyrrolidine-1-carboxamide::CHEMBL395979

SMILES: CN([C@H]1CCN(C1)C1CCOCC1)C(=O)N1CC[C@@H](C1)n1cnc2cc(sc2c1=O)-c1ccc2OCCOc2c1

InChI Key: InChIKey=BEAGBDCOCNSBFF-VXKWHMMOSA-N

Data: 1 KI

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 1 hit for monomerid = 50206674   

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
Melanin-concentrating hormone receptor (Homo sapiens (Human))	BDBM50206674 ((S)-3-(6-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-o...) Show SMILES CN([C@H]1CCN(C1)C1CCOCC1)C(=O)N1CC[C@@H](C1)n1cnc2cc(sc2c1=O)-c1ccc2OCCOc2c1 Show InChI InChI=1S/C29H35N5O5S/c1-31(21-4-8-32(16-21)20-6-10-37-11-7-20)29(36)33-9-5-22(17-33)34-18-30-23-15-26(40-27(23)28(34)35)19-2-3-24-25(14-19)39-13-12-38-24/h2-3,14-15,18,20-22H,4-13,16-17H2,1H3/t21-,22-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	45	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences Inc. Curated by ChEMBL					Assay Description Binding affinity to human MCHR1				Bioorg Med Chem Lett 17: 2535-9 (2007) Article DOI: 10.1016/j.bmcl.2007.02.012 BindingDB Entry DOI: 10.7270/Q23778CV
					More data for this Ligand-Target Pair