Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Signal transducer and activator of transcription 3' and Ligand = 'BDBM50514301'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM50514301 (CHEMBL4461538) Show SMILES [H][C@]12CC[C@H](N1C(=O)[C@H](CCCC2)NC(=O)c1cc2cc(CP(O)(O)=O)ccc2[nH]1)C(=O)N[C@@H](CCC(N)=O)C(=O)NCc1ccccc1 |r| Show InChI InChI=1S/C33H41N6O8P/c34-29(40)15-13-25(30(41)35-18-20-6-2-1-3-7-20)37-32(43)28-14-11-23-8-4-5-9-26(33(44)39(23)28)38-31(42)27-17-22-16-21(19-48(45,46)47)10-12-24(22)36-27/h1-3,6-7,10,12,16-17,23,25-26,28,36H,4-5,8-9,11,13-15,18-19H2,(H2,34,40)(H,35,41)(H,37,43)(H,38,42)(H2,45,46,47)/t23-,25-,26-,28-/m0/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	761	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity to STAT3 (unknown origin)				J Med Chem 62: 11280-11300 (2019) Article DOI: 10.1021/acs.jmedchem.9b01530 BindingDB Entry DOI: 10.7270/Q2FF3WQF
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