BDBM50198780 4-(3-((S)-1-((S)-2-((S)-5-amino-1-(benzylamino)-1,5-dioxopentan-2-ylcarbamoyl)pyrrolidin-1-yl)-4-methyl-1-oxopentan-2-ylamino)-3-oxoprop-1-enyl)phenyl dihydrogen phosphate::CHEMBL267246::pCin-Leu-Pro-Gln-NHBn::pCinn-Leu-Pro-Gln-NHBn
SMILES: CC(C)C[C@H](NC(=O)\C=C\c1ccc(OP(O)(O)=O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)NCc1ccccc1
InChI Key: InChIKey=VEUZYVYBHZXTHH-NQPRZGKRSA-N
Data: 3 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Signal transducer and activator of transcription 3 (Homo sapiens (Human)) | BDBM50198780 (4-(3-((S)-1-((S)-2-((S)-5-amino-1-(benzylamino)-1,...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 135 | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Texas Curated by ChEMBL | Assay Description Inhibition of Stat3 | Bioorg Med Chem Lett 17: 654-6 (2007) Article DOI: 10.1016/j.bmcl.2006.10.099 BindingDB Entry DOI: 10.7270/Q2K93758 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Signal transducer and activator of transcription 3 (Homo sapiens (Human)) | BDBM50198780 (4-(3-((S)-1-((S)-2-((S)-5-amino-1-(benzylamino)-1,...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 138 | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Texas M. D. Anderson Cancer Center Curated by ChEMBL | Assay Description Inhibition of Stat3 SH2 domain by fluorescence polarization assay | J Med Chem 52: 6126-41 (2009) Article DOI: 10.1021/jm901105k BindingDB Entry DOI: 10.7270/Q2M045HH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Signal transducer and activator of transcription 3 (Homo sapiens (Human)) | BDBM50198780 (4-(3-((S)-1-((S)-2-((S)-5-amino-1-(benzylamino)-1,...) | PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 138 | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Texas M. D. Anderson Cancer Center Curated by ChEMBL | Assay Description Inhibition of Stat3 (unknown origin) by fluorescence polarization assay | J Med Chem 52: 2429-42 (2009) Article DOI: 10.1021/jm801491w BindingDB Entry DOI: 10.7270/Q28C9W4V | |||||||||||
More data for this Ligand-Target Pair |