BDBM50443304 CHEMBL3088227

SMILES: Cc1cccc(c1)-n1nc(cc1-c1ccccc1)C(O)=O

InChI Key: InChIKey=XDKDJRWOHMIRGN-UHFFFAOYSA-N

Data: 4 Kd

PDB links: 2 PDB IDs match this monomer.

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 4 hits for monomerid = 50443304   

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
Replication protein A 70 kDa DNA-binding subunit (Homo sapiens (Human))	BDBM50443304 (CHEMBL3088227) Show SMILES Cc1cccc(c1)-n1nc(cc1-c1ccccc1)C(O)=O Show InChI InChI=1S/C17H14N2O2/c1-12-6-5-9-14(10-12)19-16(11-15(18-19)17(20)21)13-7-3-2-4-8-13/h2-11H,1H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	>500	n/a	n/a	n/a	n/a	n/a
Vanderbilt University School of Medicine Curated by ChEMBL					Assay Description Binding affinity to RPA70N protein (unknown origin) incubated for 1 hr using FITC-ATRIP/FITC-ATRIP2 peptide probe by fluorescence polarization anisot...				ACS Med Chem Lett 6: 140-5 (2015) Article DOI: 10.1021/ml5003629 BindingDB Entry DOI: 10.7270/Q2HM5B5R
					More data for this Ligand-Target Pair				3D Structure (crystal)
Replication protein A 70 kDa DNA-binding subunit (Homo sapiens (Human))	BDBM50443304 (CHEMBL3088227) Show SMILES Cc1cccc(c1)-n1nc(cc1-c1ccccc1)C(O)=O Show InChI InChI=1S/C17H14N2O2/c1-12-6-5-9-14(10-12)19-16(11-15(18-19)17(20)21)13-7-3-2-4-8-13/h2-11H,1H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	5.80E+5	n/a	n/a	n/a	n/a	n/a
Vanderbilt University School of Medicine Curated by ChEMBL					Assay Description Binding affinity to RPA70N (1 to 120) site1 (unknown origin) expressed in Escherichia coli BL21-DE3 cells by NMR spectroscopy				J Med Chem 56: 9242-50 (2013) Article DOI: 10.1021/jm401333u BindingDB Entry DOI: 10.7270/Q2B56M5D
					More data for this Ligand-Target Pair				3D Structure (crystal)
Replication protein A 70 kDa DNA-binding subunit (Homo sapiens (Human))	BDBM50443304 (CHEMBL3088227) Show SMILES Cc1cccc(c1)-n1nc(cc1-c1ccccc1)C(O)=O Show InChI InChI=1S/C17H14N2O2/c1-12-6-5-9-14(10-12)19-16(11-15(18-19)17(20)21)13-7-3-2-4-8-13/h2-11H,1H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	>2.00E+6	n/a	n/a	n/a	n/a	n/a
Vanderbilt University School of Medicine Curated by ChEMBL					Assay Description Binding affinity to RPA70N (1 to 120) site2 (unknown origin) expressed in Escherichia coli BL21-DE3 cells by NMR spectroscopy				J Med Chem 56: 9242-50 (2013) Article DOI: 10.1021/jm401333u BindingDB Entry DOI: 10.7270/Q2B56M5D
					More data for this Ligand-Target Pair				3D Structure (crystal)
Replication protein A 70 kDa DNA-binding subunit (Homo sapiens (Human))	BDBM50443304 (CHEMBL3088227) Show SMILES Cc1cccc(c1)-n1nc(cc1-c1ccccc1)C(O)=O Show InChI InChI=1S/C17H14N2O2/c1-12-6-5-9-14(10-12)19-16(11-15(18-19)17(20)21)13-7-3-2-4-8-13/h2-11H,1H3,(H,20,21)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a
Vanderbilt University School of Medicine Curated by ChEMBL					Assay Description Binding affinity to RPA70N protein (unknown origin) by HSQC NMR-based titration method				ACS Med Chem Lett 6: 140-5 (2015) Article DOI: 10.1021/ml5003629 BindingDB Entry DOI: 10.7270/Q2HM5B5R
					More data for this Ligand-Target Pair				3D Structure (crystal)