BDBM50062327 (R)-N*4*-Hydroxy-2-isobutyl-N*1*-((R)-3-methyl-1-methylcarbamoyl-butyl)-succinamide::CHEMBL70570
SMILES: CNC(=O)[C@@H](CC(C)C)NC(=O)[C@H](CC(C)C)CC(=O)NO
InChI Key: InChIKey=CJQLPOBRKZCBHK-VXGBXAGGSA-N
Data: 3 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Neutrophil collagenase (Homo sapiens (Human)) | BDBM50062327 ((R)-N*4*-Hydroxy-2-isobutyl-N*1*-((R)-3-methyl-1-m...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.650 | 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 | |||||||||||||
72 kDa type IV collagenase (Homo sapiens (Human)) | BDBM50062327 ((R)-N*4*-Hydroxy-2-isobutyl-N*1*-((R)-3-methyl-1-m...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.10 | 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 | |||||||||||||
Matrix metalloproteinase-9 (Homo sapiens (Human)) | BDBM50062327 ((R)-N*4*-Hydroxy-2-isobutyl-N*1*-((R)-3-methyl-1-m...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 2.5 | 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 |