BDBM50267447 4-(3-((3S,6S)-6-((S)-5-amino-1-((2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-ylamino)-1,5-dioxopentan-2-ylcarbamoyl)-4-oxo-1,2,3,4,6,7-hexahydroazepino[3,2,1-hi]indol-3-ylamino)-3-oxopropyl)phenyl dihydrogen phosphate::CHEMBL508900

SMILES: C[C@@H](O)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1Cc2cccc3CC[C@H](NC(=O)CCc4ccc(OP(O)(O)=O)cc4)C(=O)N1c23)C(N)=O

InChI Key: InChIKey=UIJCKLYFZVETDO-PRBLUTEPSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50267447   

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))	BDBM50267447 (4-(3-((3S,6S)-6-((S)-5-amino-1-((2S,3R)-1-amino-3-...) Show SMILES C[C@@H](O)[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H]1Cc2cccc3CC[C@H](NC(=O)CCc4ccc(OP(O)(O)=O)cc4)C(=O)N1c23)C(N)=O |r| Show InChI InChI=1S/C31H39N6O11P/c1-16(38)26(28(33)41)36-29(42)21(12-13-24(32)39)35-30(43)23-15-19-4-2-3-18-8-11-22(31(44)37(23)27(18)19)34-25(40)14-7-17-5-9-20(10-6-17)48-49(45,46)47/h2-6,9-10,16,21-23,26,38H,7-8,11-15H2,1H3,(H2,32,39)(H2,33,41)(H,34,40)(H,35,43)(H,36,42)(H2,45,46,47)/t16-,21+,22+,23+,26+/m1/s1	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.24E+3	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