BDBM50140302 CHEMBL279343::Cyclopropanecarboxylic acid [(1R,2R)-2-(2-propyl-2,3-dihydro-benzooxazol-7-yl)-cyclopropylmethyl]-amide

SMILES: CCCC1Nc2cccc([C@@H]3C[C@H]3CNC(=O)C3CC3)c2O1

InChI Key: InChIKey=MUMGWDYNZQYWRF-XNVGXSDDSA-N

Data: 2 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 2 hits for monomerid = 50140302   

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
Melatonin receptor (Homo sapiens (Human))	BDBM50140302 (CHEMBL279343 | Cyclopropanecarboxylic acid [(1R,2R...) Show SMILES CCCC1Nc2cccc([C@@H]3C[C@H]3CNC(=O)C3CC3)c2O1 Show InChI InChI=1S/C18H24N2O2/c1-2-4-16-20-15-6-3-5-13(17(15)22-16)14-9-12(14)10-19-18(21)11-7-8-11/h3,5-6,11-12,14,16,20H,2,4,7-10H2,1H3,(H,19,21)/t12-,14+,16?/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding of 2-[125I]-iodomelatonin to membrane preparations of NIH3T3 cells stably expressing human Melatonin receptor type 1B				Bioorg Med Chem Lett 14: 1197-200 (2004) Article DOI: 10.1016/j.bmcl.2003.12.052 BindingDB Entry DOI: 10.7270/Q2CF9PJC
					More data for this Ligand-Target Pair
Melatonin receptor (Homo sapiens (Human))	BDBM50140302 (CHEMBL279343 | Cyclopropanecarboxylic acid [(1R,2R...) Show SMILES CCCC1Nc2cccc([C@@H]3C[C@H]3CNC(=O)C3CC3)c2O1 Show InChI InChI=1S/C18H24N2O2/c1-2-4-16-20-15-6-3-5-13(17(15)22-16)14-9-12(14)10-19-18(21)11-7-8-11/h3,5-6,11-12,14,16,20H,2,4,7-10H2,1H3,(H,19,21)/t12-,14+,16?/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.180	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding of 2-[125I]-iodomelatonin to membrane preparations of NIH3T3 cells stably expressing human Melatonin receptor type 1A				Bioorg Med Chem Lett 14: 1197-200 (2004) Article DOI: 10.1016/j.bmcl.2003.12.052 BindingDB Entry DOI: 10.7270/Q2CF9PJC
					More data for this Ligand-Target Pair