BDBM50292701 (1R,2S)-ethyl 1-(3-bromo-4-((2-methylquinolin-4-yl)methoxy)benzyl)-2-(hydroxycarbamoyl)cyclopropanecarboxylate::CHEMBL495537

SMILES: CCOC(=O)[C@@]1(Cc2ccc(OCc3cc(C)nc4ccccc34)c(Br)c2)C[C@@H]1C(=O)NO

InChI Key: InChIKey=LQKKQRMPHRHYOQ-CLOONOSVSA-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 = 50292701   

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
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50292701 ((1R,2S)-ethyl 1-(3-bromo-4-((2-methylquinolin-4-yl...) Show SMILES CCOC(=O)[C@@]1(Cc2ccc(OCc3cc(C)nc4ccccc34)c(Br)c2)C[C@@H]1C(=O)NO |r| Show InChI InChI=1S/C25H25BrN2O5/c1-3-32-24(30)25(13-19(25)23(29)28-31)12-16-8-9-22(20(26)11-16)33-14-17-10-15(2)27-21-7-5-4-6-18(17)21/h4-11,19,31H,3,12-14H2,1-2H3,(H,28,29)/t19-,25+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	381	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of human recombinant TACE				Bioorg Med Chem Lett 18: 5809-14 (2009) Article DOI: 10.1016/j.bmcl.2008.09.045 BindingDB Entry DOI: 10.7270/Q2N29WZX
					More data for this Ligand-Target Pair