BDBM50087223 (S)-2-[(E)-3-(3-Chloro-phenyl)-acryloyl]-7-(2,4-dichloro-benzyloxy)-6,8-diiodo-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid::CHEMBL347359

SMILES: OC(=O)[C@@H]1Cc2cc(I)c(OCc3ccc(Cl)cc3Cl)c(I)c2CN1C(=O)\C=C\c1cccc(Cl)c1

InChI Key: InChIKey=GYSIPWCTXIVMBA-SNXGKTBFSA-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 = 50087223   

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
Dual specificity phosphatase Cdc25B (Homo sapiens (Human))	BDBM50087223 ((S)-2-[(E)-3-(3-Chloro-phenyl)-acryloyl]-7-(2,4-di...) Show SMILES OC(=O)[C@@H]1Cc2cc(I)c(OCc3ccc(Cl)cc3Cl)c(I)c2CN1C(=O)\C=C\c1cccc(Cl)c1 Show InChI InChI=1S/C26H18Cl3I2NO4/c27-17-3-1-2-14(8-17)4-7-23(33)32-12-19-16(10-22(32)26(34)35)9-21(30)25(24(19)31)36-13-15-5-6-18(28)11-20(15)29/h1-9,11,22H,10,12-13H2,(H,34,35)/b7-4+/t22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacia & Upjohn Company Curated by ChEMBL					Assay Description Compound was measured for its inhibitory activity against Cell division cycle 25B				Bioorg Med Chem Lett 10: 649-52 (2000) BindingDB Entry DOI: 10.7270/Q2KS6QRN
					More data for this Ligand-Target Pair