BDBM20282 4-{[4-(hexylcarbamoyl)-2-(naphthalen-1-yl)-1,3-oxazol-5-yl]methyl}phenoxyphosphonic acid::S3I-M2001
SMILES: CCCCCCNC(=O)c1nc(oc1Cc1ccc(OP(O)(O)=O)cc1)-c1cccc2ccccc12
InChI Key: InChIKey=NUEVMWXZKGBDPT-UHFFFAOYSA-N
Data: 5 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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Transcription Factor STAT3 (Mus musculus (mouse)) | BDBM20282 (4-{[4-(hexylcarbamoyl)-2-(naphthalen-1-yl)-1,3-oxa...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 7.90E+4 | n/a | n/a | n/a | n/a | 7.8 | 22 |
University of Central Florida College of Medicine | Assay Description STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ... | ACS Chem Biol 2: 787-98 (2007) Article DOI: 10.1021/cb7001973 BindingDB Entry DOI: 10.7270/Q29K48HT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Transcription Factor STAT1 (Homo sapiens (Human)) | BDBM20282 (4-{[4-(hexylcarbamoyl)-2-(naphthalen-1-yl)-1,3-oxa...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.59E+5 | n/a | n/a | n/a | n/a | 7.8 | 22 |
University of Central Florida College of Medicine | Assay Description STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ... | ACS Chem Biol 2: 787-98 (2007) Article DOI: 10.1021/cb7001973 BindingDB Entry DOI: 10.7270/Q29K48HT | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Transcription Factor STAT3 (Mus musculus (mouse)) | BDBM20282 (4-{[4-(hexylcarbamoyl)-2-(naphthalen-1-yl)-1,3-oxa...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 5.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Southern California Curated by ChEMBL | Assay Description Inhibition of STAT3 dimerization in v-Src transformed mouse NIH/3T3 cells overexpressing human EGFR assessed as suppression of STAT3-DNA interaction ... | J Med Chem 55: 6645-68 (2012) Article DOI: 10.1021/jm300207s BindingDB Entry DOI: 10.7270/Q2CJ8FKK | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Signal transducer and activator of transcription 3 (Homo sapiens (Human)) | BDBM20282 (4-{[4-(hexylcarbamoyl)-2-(naphthalen-1-yl)-1,3-oxa...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | US Patent | n/a | n/a | 5.80E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Central Florida Research Foundation, Inc. US Patent | Assay Description A screening process evaluated in vitro disruption of STAT3(dimer)-DNA formation through a previously published EMSA based assays, giving a valuable i... | US Patent US8969578 (2015) BindingDB Entry DOI: 10.7270/Q2WD3Z84 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Transcription Factor STAT1:STAT3 Dimer (Mus musculus (mouse)-Homo sapiens (Human)) | BDBM20282 (4-{[4-(hexylcarbamoyl)-2-(naphthalen-1-yl)-1,3-oxa...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 9.20E+4 | n/a | n/a | n/a | n/a | 7.8 | 22 |
University of Central Florida College of Medicine | Assay Description STAT proteins were expressed in Sf9 cells from a baculovirus encoding the recombinant protein. A nuclear extract of the Sf9 cells was incubated with ... | ACS Chem Biol 2: 787-98 (2007) Article DOI: 10.1021/cb7001973 BindingDB Entry DOI: 10.7270/Q29K48HT | |||||||||||
More data for this Ligand-Target Pair |