BDBM50514867 CHEMBL4584415

SMILES: Clc1ccc(NC(=O)CN2C(=O)COC2=O)cc1S(=O)(=O)N1CCCC1

InChI Key: InChIKey=QAOWRPTUXWPJAT-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50514867   

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
ATPase family AAA domain-containing protein 2 (Homo sapiens (Human))	BDBM50514867 (CHEMBL4584415) Show SMILES Clc1ccc(NC(=O)CN2C(=O)COC2=O)cc1S(=O)(=O)N1CCCC1 Show InChI InChI=1S/C15H16ClN3O6S/c16-11-4-3-10(7-12(11)26(23,24)18-5-1-2-6-18)17-13(20)8-19-14(21)9-25-15(19)22/h3-4,7H,1-2,5-6,8-9H2,(H,17,20)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Strathclyde Curated by ChEMBL					Assay Description Displacement of Alexa Fluor 488-labeled ligand from FLAG-6His-Tev-fused ATAD2 (981 to 1121 residue) (unknown origin) measured after 30 mins by TR-FRE...				J Med Chem 63: 5212-5241 (2020) Article DOI: 10.1021/acs.jmedchem.0c00021
					More data for this Ligand-Target Pair
Cat eye syndrome critical region protein 2 (Homo sapiens (Human))	BDBM50514867 (CHEMBL4584415) Show SMILES Clc1ccc(NC(=O)CN2C(=O)COC2=O)cc1S(=O)(=O)N1CCCC1 Show InChI InChI=1S/C15H16ClN3O6S/c16-11-4-3-10(7-12(11)26(23,24)18-5-1-2-6-18)17-13(20)8-19-14(21)9-25-15(19)22/h3-4,7H,1-2,5-6,8-9H2,(H,17,20)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.59E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Strathclyde Curated by ChEMBL					Assay Description Displacement of Alexa Fluor 647-labeled GSK tracer from FLAG-6His-Tev-fused CECR2 (424 to 543 residue) (unknown origin) measured after 15 mins by TR-...				J Med Chem 63: 5212-5241 (2020) Article DOI: 10.1021/acs.jmedchem.0c00021
					More data for this Ligand-Target Pair
Bromodomain-containing protein 4 (Homo sapiens (Human))	BDBM50514867 (CHEMBL4584415) Show SMILES Clc1ccc(NC(=O)CN2C(=O)COC2=O)cc1S(=O)(=O)N1CCCC1 Show InChI InChI=1S/C15H16ClN3O6S/c16-11-4-3-10(7-12(11)26(23,24)18-5-1-2-6-18)17-13(20)8-19-14(21)9-25-15(19)22/h3-4,7H,1-2,5-6,8-9H2,(H,17,20)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	<5.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Strathclyde Curated by ChEMBL					Assay Description Displacement of Alexa Fluor 647-labeled ligand from BRD4 BD1 Y390A mutant (1 to 477 residue) (unknown origin) measured after 30 mins by TR-FRET assay				J Med Chem 63: 5212-5241 (2020) Article DOI: 10.1021/acs.jmedchem.0c00021
					More data for this Ligand-Target Pair