BDBM50149743 (Z)-2-(5-(3-(benzyloxy)benzylidene)-4-oxo-2-thioxothiazolidin-3-yl)acetic acid::CHEMBL184768::[5-(3-Benzyloxy-benzylidene)-4-oxo-2-thioxo-thiazolidin-3-yl]-acetic acid
SMILES: OC(=O)CN1C(=S)S\C(=C/c2cccc(OCc3ccccc3)c2)C1=O
InChI Key: InChIKey=DHUZZZSRYGMFNN-YBEGLDIGSA-N
Data: 4 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 |
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Dolichyl-phosphate-mannose--protein mannosyltransferase 1 (Candida albicans) | BDBM50149743![]() ((Z)-2-(5-(3-(benzyloxy)benzylidene)-4-oxo-2-thioxo...) | KEGG UniProtKB/SwissProt 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 |
Oxfordshire OX14 4YS Curated by ChEMBL | Assay Description In vitro inhibition of Candida albicans protein mannosyl transferase 1 | Bioorg Med Chem Lett 14: 3975-8 (2004) Article DOI: 10.1016/j.bmcl.2004.05.050 BindingDB Entry DOI: 10.7270/Q22J6B96 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Protein-tyrosine phosphatase 1B (Homo sapiens (Human)) | BDBM50149743![]() ((Z)-2-(5-(3-(benzyloxy)benzylidene)-4-oxo-2-thioxo...) | 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 | 4.31E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Messina Curated by ChEMBL | Assay Description Inhibition of human full-length GST-fused PTP1B expressed in bacterial expression system using pNPP as substrate | Bioorg Med Chem Lett 28: 3712-3720 (2018) Article DOI: 10.1016/j.bmcl.2018.10.024 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldose reductase (Homo sapiens (Human)) | BDBM50149743![]() ((Z)-2-(5-(3-(benzyloxy)benzylidene)-4-oxo-2-thioxo...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet ![]() | Purchase CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 53 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Messina Curated by ChEMBL | Assay Description Inhibition of human recombinant aldose reductase expressed in Escherichia coli BL21 (DE3) pLysS assessed as reduction in NADPH oxidation using L-idos... | Bioorg Med Chem Lett 28: 3712-3720 (2018) Article DOI: 10.1016/j.bmcl.2018.10.024 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Aldose reductase (ALR2) (Bos taurus (Cattle)) | BDBM50149743![]() ((Z)-2-(5-(3-(benzyloxy)benzylidene)-4-oxo-2-thioxo...) | PDB GoogleScholar AffyNet ![]() | Purchase CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 130 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Messina Curated by ChEMBL | Assay Description Inhibition of bovine lens aldose reductase assessed as inhibition of NDAPH oxidation by non-linear regression analysis | Bioorg Med Chem Lett 21: 200-3 (2010) Article DOI: 10.1016/j.bmcl.2010.11.041 BindingDB Entry DOI: 10.7270/Q2ZP46C4 | |||||||||||
More data for this Ligand-Target Pair |