BDBM114221 (5Z)-5-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-N-(phenylmethyl)-1,2-dihydro-1,2,3-triazole-4-carboxamide::(5Z)-5-(6-oxo-1-cyclohexa-2,4-dienylidene)-N-(phenylmethyl)-1,2-dihydrotriazole-4-carboxamide::(5Z)-N-benzyl-5-(6-ketocyclohexa-2,4-dien-1-ylidene)-1,2-dihydrotriazole-4-carboxamide::(5Z)-N-benzyl-5-(6-oxocyclohexa-2,4-dien-1-ylidene)-1,2-dihydrotriazole-4-carboxamide::MLS000053062::N-benzyl-5-(2-hydroxyphenyl)-1H-1,2,3-triazole-4-carboxamide::SMR000069330::cid_5368408
SMILES: Oc1ccccc1-c1nn[nH]c1C(=O)NCc1ccccc1
InChI Key: InChIKey=XXECKKNKXQPNRO-UHFFFAOYSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase beta-3 (Homo sapiens (Human)) | BDBM114221 ((5Z)-5-(6-oxidanylidenecyclohexa-2,4-dien-1-yliden...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | PCBioAssay | n/a | n/a | 1.22E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute Ass... | PubChem Bioassay (2014) BindingDB Entry DOI: 10.7270/Q2S46QKQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1 [1-999,I813T] (Homo sapiens (Human)) | BDBM114221 ((5Z)-5-(6-oxidanylidenecyclohexa-2,4-dien-1-yliden...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem | PCBioAssay | n/a | n/a | 1.08E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay | Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute Ass... | PubChem Bioassay (2014) BindingDB Entry DOI: 10.7270/Q2NC5ZV0 | |||||||||||
More data for this Ligand-Target Pair |