BDBM50242633 CHEMBL4103623

SMILES: NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCCC(C2)Oc2ccccc2)c1

InChI Key: InChIKey=RROZUMONXJGWHO-QXMHVHEDSA-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 = 50242633   

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
Protein mono-ADP-ribosyltransferase PARP14 (Homo sapiens (Human))	BDBM50242633 (CHEMBL4103623) Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCCC(C2)Oc2ccccc2)c1 Show InChI InChI=1S/C22H23N3O4/c23-22(28)16-6-4-7-17(14-16)24-20(26)11-12-21(27)25-13-5-10-19(15-25)29-18-8-2-1-3-9-18/h1-4,6-9,11-12,14,19H,5,10,13,15H2,(H2,23,28)(H,24,26)/b12-11-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
McDaniel College Curated by ChEMBL					Assay Description Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...				Bioorg Med Chem Lett 27: 2907-2911 (2017) Article DOI: 10.1016/j.bmcl.2017.04.089 BindingDB Entry DOI: 10.7270/Q24X5B5F
					More data for this Ligand-Target Pair
Protein mono-ADP-ribosyltransferase PARP14 (Homo sapiens (Human))	BDBM50242633 (CHEMBL4103623) Show SMILES NC(=O)c1cccc(NC(=O)\C=C/C(=O)N2CCCC(C2)Oc2ccccc2)c1 Show InChI InChI=1S/C22H23N3O4/c23-22(28)16-6-4-7-17(14-16)24-20(26)11-12-21(27)25-13-5-10-19(15-25)29-18-8-2-1-3-9-18/h1-4,6-9,11-12,14,19H,5,10,13,15H2,(H2,23,28)(H,24,26)/b12-11-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.02E+3	n/a	n/a	n/a	n/a	n/a	n/a
McDaniel College Curated by ChEMBL					Assay Description Inhibition of recombinant human His6-tagged PARP14 catalytic/WWE domain (1459 to 1801 residues) expressed in Escherichia coli BL21(DE3) preincubated ...				Bioorg Med Chem Lett 27: 2907-2911 (2017) Article DOI: 10.1016/j.bmcl.2017.04.089 BindingDB Entry DOI: 10.7270/Q24X5B5F
					More data for this Ligand-Target Pair