BDBM50211930 4-(5-((3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl)methylene)-4-oxo-2-thioxothiazolidin-3-yl)butanoic acid::CHEMBL226156
SMILES: OC(=O)CCCN1C(=S)S\C(=C/c2cn(nc2-c2ccc(Cl)cc2)-c2ccccc2)C1=O
InChI Key: InChIKey=FSRVYXQOXYGCLR-UYRXBGFRSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Protein-tyrosine phosphatase 1B (Homo sapiens (Human)) | BDBM50211930 (4-(5-((3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.27E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Yanbian University Curated by ChEMBL | Assay Description Inhibition of PTP1B (unknown origin) using pNPP as substrate | Bioorg Med Chem Lett 29: 1187-1193 (2019) Article DOI: 10.1016/j.bmcl.2019.03.023 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Enoyl-acyl-carrier protein reductase (Plasmodium falciparum) | BDBM50211930 (4-(5-((3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl...) | PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 5.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Science Curated by ChEMBL | Assay Description Inhibition of Plasmodium falciparum recombinant enoyl ACP reductase expressed in BL21 (DE3) cells | J Med Chem 50: 2665-75 (2007) Article DOI: 10.1021/jm061257w BindingDB Entry DOI: 10.7270/Q2ZP46X9 | |||||||||||
More data for this Ligand-Target Pair |