BDBM50043745 CHEMBL47907::{(R)-1-[(S)-3-Methyl-1-((S)-1-methylcarbamoyl-2-phenyl-ethylcarbamoyl)-butylamino]-propyl}-phosphonic acid
SMILES: CC[C@H](N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)NC)P(O)(O)=O
InChI Key: InChIKey=UTCZEIUWFUVIQV-YESZJQIVSA-N
Data: 2 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Interstitial collagenase (Homo sapiens (Human)) | BDBM50043745 (CHEMBL47907 | {(R)-1-[(S)-3-Methyl-1-((S)-1-methyl...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article | n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of human fibroblast collagenase | Bioorg Med Chem Lett 4: 2833-2836 (1994) Article DOI: 10.1016/S0960-894X(01)80823-4 BindingDB Entry DOI: 10.7270/Q2HH6K16 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Interstitial collagenase (Homo sapiens (Human)) | BDBM50043745 (CHEMBL47907 | {(R)-1-[(S)-3-Methyl-1-((S)-1-methyl...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 230 | n/a | n/a | n/a | n/a | n/a | n/a |
SmithKline Beecham Pharmaceuticals Curated by ChEMBL | Assay Description Inhibition of degradation of radiolabeled rat skin type I collagen by semipurified human lung fibroblast collagenase | J Med Chem 37: 158-69 (1994) BindingDB Entry DOI: 10.7270/Q25M64SM | |||||||||||
More data for this Ligand-Target Pair |