BDBM50270378 CHEMBL516131::trans-1,1,3,3-tetraisopropyl-2-(3-(4-nitrophenyl)-2-(trimethylsilyl)oxiran-2-yl)thiourea
SMILES: CC(C)N(C(C)C)P(=S)(N(C(C)C)C(C)C)[C@@]1(O[C@H]1c1ccc(cc1)[N+]([O-])=O)[Si](C)(C)C
InChI Key: InChIKey=PAVCLAGPWORXFT-XZOQPEGZSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Thrombin-activatable fibrinolysis (TAFI) (Homo sapiens (Human)) | BDBM50270378 (CHEMBL516131 | trans-1,1,3,3-tetraisopropyl-2-(3-(...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Autònoma de Barcelona Curated by ChEMBL | Assay Description Inhibition of human carboxypeptidase B | Bioorg Med Chem 16: 4823-8 (2008) Article DOI: 10.1016/j.bmc.2008.03.047 BindingDB Entry DOI: 10.7270/Q2CV4HJJ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carboxypeptidase A1 (Bos taurus (bovine)) | BDBM50270378 (CHEMBL516131 | trans-1,1,3,3-tetraisopropyl-2-(3-(...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 4.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universitat Autònoma de Barcelona Curated by ChEMBL | Assay Description Inhibition of bovine pancreatic carboxypeptidase A | Bioorg Med Chem 16: 4823-8 (2008) Article DOI: 10.1016/j.bmc.2008.03.047 BindingDB Entry DOI: 10.7270/Q2CV4HJJ | |||||||||||
More data for this Ligand-Target Pair |