BDBM50514864 CHEMBL4521850

SMILES: Clc1ccc(NC(=O)CN2C(=O)CNC2=O)cc1S(=O)(=O)N1CCC(C1)C1CC1

InChI Key: InChIKey=XSDOLOPLLGGSCB-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 = 50514864   

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))	BDBM50514864 (CHEMBL4521850) Show SMILES Clc1ccc(NC(=O)CN2C(=O)CNC2=O)cc1S(=O)(=O)N1CCC(C1)C1CC1 Show InChI InChI=1S/C18H21ClN4O5S/c19-14-4-3-13(21-16(24)10-23-17(25)8-20-18(23)26)7-15(14)29(27,28)22-6-5-12(9-22)11-1-2-11/h3-4,7,11-12H,1-2,5-6,8-10H2,(H,20,26)(H,21,24)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	501	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))	BDBM50514864 (CHEMBL4521850) Show SMILES Clc1ccc(NC(=O)CN2C(=O)CNC2=O)cc1S(=O)(=O)N1CCC(C1)C1CC1 Show InChI InChI=1S/C18H21ClN4O5S/c19-14-4-3-13(21-16(24)10-23-17(25)8-20-18(23)26)7-15(14)29(27,28)22-6-5-12(9-22)11-1-2-11/h3-4,7,11-12H,1-2,5-6,8-10H2,(H,20,26)(H,21,24)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	501	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))	BDBM50514864 (CHEMBL4521850) Show SMILES Clc1ccc(NC(=O)CN2C(=O)CNC2=O)cc1S(=O)(=O)N1CCC(C1)C1CC1 Show InChI InChI=1S/C18H21ClN4O5S/c19-14-4-3-13(21-16(24)10-23-17(25)8-20-18(23)26)7-15(14)29(27,28)22-6-5-12(9-22)11-1-2-11/h3-4,7,11-12H,1-2,5-6,8-10H2,(H,20,26)(H,21,24)	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