BDBM50267317 (R)-5-(3-Chloro-4-fluorophenylamino)-5-oxo-4-(3,4,5-trimethoxybenzamido)pentanoic acid::CHEMBL477656

SMILES: COc1cc(cc(OC)c1OC)C(=O)N[C@H](CCC(O)=O)C(=O)Nc1ccc(F)c(Cl)c1

InChI Key: InChIKey=WXSBCFUNXZCXIL-OAHLLOKOSA-N

Data: 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 2 hits for monomerid = 50267317   

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
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50267317 ((R)-5-(3-Chloro-4-fluorophenylamino)-5-oxo-4-(3,4,...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N[C@H](CCC(O)=O)C(=O)Nc1ccc(F)c(Cl)c1 |r| Show InChI InChI=1S/C21H22ClFN2O7/c1-30-16-8-11(9-17(31-2)19(16)32-3)20(28)25-15(6-7-18(26)27)21(29)24-12-4-5-14(23)13(22)10-12/h4-5,8-10,15H,6-7H2,1-3H3,(H,24,29)(H,25,28)(H,26,27)/t15-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.07E+5	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of MMP2 by spectrophotometry				Bioorg Med Chem 17: 3053-60 (2009) Article DOI: 10.1016/j.bmc.2009.02.063 BindingDB Entry DOI: 10.7270/Q2NP25BQ
					More data for this Ligand-Target Pair
Aminopeptidase N (Sus scrofa (Pig))	BDBM50267317 ((R)-5-(3-Chloro-4-fluorophenylamino)-5-oxo-4-(3,4,...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N[C@H](CCC(O)=O)C(=O)Nc1ccc(F)c(Cl)c1 |r| Show InChI InChI=1S/C21H22ClFN2O7/c1-30-16-8-11(9-17(31-2)19(16)32-3)20(28)25-15(6-7-18(26)27)21(29)24-12-4-5-14(23)13(22)10-12/h4-5,8-10,15H,6-7H2,1-3H3,(H,24,29)(H,25,28)(H,26,27)/t15-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.85E+4	n/a	n/a	n/a	n/a	n/a	n/a
Shandong University Curated by ChEMBL					Assay Description Inhibition of pig kidney microsome aminopeptidase N by UV-visible spectrophotometer				Bioorg Med Chem 17: 3053-60 (2009) Article DOI: 10.1016/j.bmc.2009.02.063 BindingDB Entry DOI: 10.7270/Q2NP25BQ
					More data for this Ligand-Target Pair