BDBM50267958 (R)-4-(4-Carboxy-2-(3,4,5-trimethoxybenzamido)butanamido)benzoic acid::CHEMBL489026

SMILES: COc1cc(cc(OC)c1OC)C(=O)N[C@H](CCC(O)=O)C(=O)Nc1ccc(cc1)C(O)=O

InChI Key: InChIKey=VUDJWDOZBXAVEB-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 = 50267958   

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))	BDBM50267958 ((R)-4-(4-Carboxy-2-(3,4,5-trimethoxybenzamido)buta...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N[C@H](CCC(O)=O)C(=O)Nc1ccc(cc1)C(O)=O |r| Show InChI InChI=1S/C22H24N2O9/c1-31-16-10-13(11-17(32-2)19(16)33-3)20(27)24-15(8-9-18(25)26)21(28)23-14-6-4-12(5-7-14)22(29)30/h4-7,10-11,15H,8-9H2,1-3H3,(H,23,28)(H,24,27)(H,25,26)(H,29,30)/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	7.12E+4	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))	BDBM50267958 ((R)-4-(4-Carboxy-2-(3,4,5-trimethoxybenzamido)buta...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)N[C@H](CCC(O)=O)C(=O)Nc1ccc(cc1)C(O)=O |r| Show InChI InChI=1S/C22H24N2O9/c1-31-16-10-13(11-17(32-2)19(16)33-3)20(27)24-15(8-9-18(25)26)21(28)23-14-6-4-12(5-7-14)22(29)30/h4-7,10-11,15H,8-9H2,1-3H3,(H,23,28)(H,24,27)(H,25,26)(H,29,30)/t15-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.58E+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