BDBM50062342 (R)-N*4*-Hydroxy-2-isobutyl-N*1*-((R)-1-methylcarbamoyl-2-naphthalen-1-yl-ethyl)-succinamide::CHEMBL70492

SMILES: CNC(=O)[C@@H](Cc1cccc2ccccc12)NC(=O)[C@H](CC(C)C)CC(=O)NO

InChI Key: InChIKey=FYGGOGPIPBSHEF-IEBWSBKVSA-N

Data: 3 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 3 hits for monomerid = 50062342   

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))	BDBM50062342 ((R)-N*4*-Hydroxy-2-isobutyl-N*1*-((R)-1-methylcarb...) Show SMILES CNC(=O)[C@@H](Cc1cccc2ccccc12)NC(=O)[C@H](CC(C)C)CC(=O)NO Show InChI InChI=1S/C22H29N3O4/c1-14(2)11-17(13-20(26)25-29)21(27)24-19(22(28)23-3)12-16-9-6-8-15-7-4-5-10-18(15)16/h4-10,14,17,19,29H,11-13H2,1-3H3,(H,23,28)(H,24,27)(H,25,26)/t17-,19-/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	0.420	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Glycomed, Inc. Curated by ChEMBL					Assay Description Binding affinity towards 72 kDa gelatinase (Matrix metalloproteinase-2)				J Med Chem 41: 199-223 (1998) Article DOI: 10.1021/jm970494j BindingDB Entry DOI: 10.7270/Q2Q52NRB
					More data for this Ligand-Target Pair
Neutrophil collagenase (Homo sapiens (Human))	BDBM50062342 ((R)-N*4*-Hydroxy-2-isobutyl-N*1*-((R)-1-methylcarb...) Show SMILES CNC(=O)[C@@H](Cc1cccc2ccccc12)NC(=O)[C@H](CC(C)C)CC(=O)NO Show InChI InChI=1S/C22H29N3O4/c1-14(2)11-17(13-20(26)25-29)21(27)24-19(22(28)23-3)12-16-9-6-8-15-7-4-5-10-18(15)16/h4-10,14,17,19,29H,11-13H2,1-3H3,(H,23,28)(H,24,27)(H,25,26)/t17-,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.640	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Glycomed, Inc. Curated by ChEMBL					Assay Description The compound was tested for its binding affinity towards neutrophil collagenase (Matrix metalloproteinase-8)				J Med Chem 41: 199-223 (1998) Article DOI: 10.1021/jm970494j BindingDB Entry DOI: 10.7270/Q2Q52NRB
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50062342 ((R)-N*4*-Hydroxy-2-isobutyl-N*1*-((R)-1-methylcarb...) Show SMILES CNC(=O)[C@@H](Cc1cccc2ccccc12)NC(=O)[C@H](CC(C)C)CC(=O)NO Show InChI InChI=1S/C22H29N3O4/c1-14(2)11-17(13-20(26)25-29)21(27)24-19(22(28)23-3)12-16-9-6-8-15-7-4-5-10-18(15)16/h4-10,14,17,19,29H,11-13H2,1-3H3,(H,23,28)(H,24,27)(H,25,26)/t17-,19-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Glycomed, Inc. Curated by ChEMBL					Assay Description The compound was tested for its binding affinity towards 92 kDa gelatinase (Matrix metalloproteinase-9)				J Med Chem 41: 199-223 (1998) Article DOI: 10.1021/jm970494j BindingDB Entry DOI: 10.7270/Q2Q52NRB
					More data for this Ligand-Target Pair