BDBM50251687 CHEMBL4066643

SMILES: COc1ccc2c(c1)oc(=O)c1c3C(=O)C=CC(=O)c3ccc21

InChI Key: InChIKey=JODOIXOYNDWRKU-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50251687   

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 Cdc25C (Homo sapiens (Human))	BDBM50251687 (CHEMBL4066643) Show SMILES COc1ccc2c(c1)oc(=O)c1c3C(=O)C=CC(=O)c3ccc21 |c:16| Show InChI InChI=1S/C18H10O5/c1-22-9-2-3-10-11-4-5-12-13(19)6-7-14(20)16(12)17(11)18(21)23-15(10)8-9/h2-8H,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	980	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza University of Rome Curated by ChEMBL					Assay Description Compound was evaluated for its ability to displace [3H]-cytisine binding from high-affinity Nicotinic acetylcholine receptor in rat brain (principall...				Eur J Med Chem 134: 316-333 (2017) Article DOI: 10.1016/j.ejmech.2017.04.012 BindingDB Entry DOI: 10.7270/Q2WD4311
					More data for this Ligand-Target Pair
Dual specificity phosphatase Cdc25A (Homo sapiens (Human))	BDBM50251687 (CHEMBL4066643) Show SMILES COc1ccc2c(c1)oc(=O)c1c3C(=O)C=CC(=O)c3ccc21 |c:16| Show InChI InChI=1S/C18H10O5/c1-22-9-2-3-10-11-4-5-12-13(19)6-7-14(20)16(12)17(11)18(21)23-15(10)8-9/h2-8H,1H3	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.88E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza University of Rome Curated by ChEMBL					Assay Description Inhibition of recombinant human full length GST-tagged CDC25A expressed in Escherichia coli BL21-DE3 pLysS using 3-O-methylfluorescein phosphate as s...				Eur J Med Chem 134: 316-333 (2017) Article DOI: 10.1016/j.ejmech.2017.04.012 BindingDB Entry DOI: 10.7270/Q2WD4311
					More data for this Ligand-Target Pair