BDBM50068918 (S)-4-((2S,3S)-2-Benzyloxycarbonylamino-3-methyl-pentanoylamino)-5-[(S)-2-((S)-1-methoxycarbonyl-2-phenyl-ethylcarbamoyl)-pyrrolidin-1-yl]-5-oxo-pentanoic acid::CHEMBL355430
SMILES: CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)OC
InChI Key: InChIKey=NQFWNRFKRYMGAI-OXHJWIHTSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Chymase (Homo sapiens (Human)) | BDBM50068918 ((S)-4-((2S,3S)-2-Benzyloxycarbonylamino-3-methyl-p...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MCE PC cid PC sid UniChem Similars | PubMed | 3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Green Cross Research Laboratories Curated by ChEMBL | Assay Description Compound was evaluated for inhibitory activity against human heart chymase (HHC) | Bioorg Med Chem Lett 8: 919-24 (1999) BindingDB Entry DOI: 10.7270/Q2BZ656D | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Chymotrypsin (Homo sapiens (Human)) | BDBM50068918 ((S)-4-((2S,3S)-2-Benzyloxycarbonylamino-3-methyl-p...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase CHEMBL MCE PC cid PC sid UniChem Similars | PubMed | 34 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Green Cross Research Laboratories Curated by ChEMBL | Assay Description Compound was evaluated for inhibitory activity against Bovine Chymotrypsinogen | Bioorg Med Chem Lett 8: 919-24 (1999) BindingDB Entry DOI: 10.7270/Q2BZ656D | |||||||||||
More data for this Ligand-Target Pair |