BDBM50544583 CHEMBL4639242

SMILES: Cc1ccc(CCNC(=O)C(=O)CCCc2ccccc2)cc1

InChI Key: InChIKey=GCPXYBVMISMYPI-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50544583   

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
Phospholipase A and acyltransferase 2 (Homo sapiens)	BDBM50544583 (CHEMBL4639242) Show SMILES Cc1ccc(CCNC(=O)C(=O)CCCc2ccccc2)cc1 Show InChI InChI=1S/C20H23NO2/c1-16-10-12-18(13-11-16)14-15-21-20(23)19(22)9-5-8-17-6-3-2-4-7-17/h2-4,6-7,10-13H,5,8-9,14-15H2,1H3,(H,21,23)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University & Oncode Institute Curated by ChEMBL					Assay Description Inhibition of full-length C-terminal FLAG-tagged human PLAAT2 expressed in HEK293T cell lysate preincubated for 30 mins followed by MB064 addition an...				J Med Chem 63: 9340-9359 (2020)
					More data for this Ligand-Target Pair
Phospholipase A and acyltransferase 5 (Homo sapiens)	BDBM50544583 (CHEMBL4639242) Show SMILES Cc1ccc(CCNC(=O)C(=O)CCCc2ccccc2)cc1 Show InChI InChI=1S/C20H23NO2/c1-16-10-12-18(13-11-16)14-15-21-20(23)19(22)9-5-8-17-6-3-2-4-7-17/h2-4,6-7,10-13H,5,8-9,14-15H2,1H3,(H,21,23)	MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University & Oncode Institute Curated by ChEMBL					Assay Description Inhibition of full-length C-terminal FLAG-tagged human PLAAT5 expressed in HEK293T cell lysate preincubated for 30 mins followed by MB064 addition an...				J Med Chem 63: 9340-9359 (2020)
					More data for this Ligand-Target Pair
Phospholipase A and acyltransferase 4 (Homo sapiens)	BDBM50544583 (CHEMBL4639242) Show SMILES Cc1ccc(CCNC(=O)C(=O)CCCc2ccccc2)cc1 Show InChI InChI=1S/C20H23NO2/c1-16-10-12-18(13-11-16)14-15-21-20(23)19(22)9-5-8-17-6-3-2-4-7-17/h2-4,6-7,10-13H,5,8-9,14-15H2,1H3,(H,21,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University & Oncode Institute Curated by ChEMBL					Assay Description Inhibition of full-length C-terminal FLAG-tagged human PLAAT4 expressed in HEK293T cell lysate preincubated for 30 mins followed by MB064 addition an...				J Med Chem 63: 9340-9359 (2020)
					More data for this Ligand-Target Pair
Phospholipase A and acyltransferase 3 (Homo sapiens)	BDBM50544583 (CHEMBL4639242) Show SMILES Cc1ccc(CCNC(=O)C(=O)CCCc2ccccc2)cc1 Show InChI InChI=1S/C20H23NO2/c1-16-10-12-18(13-11-16)14-15-21-20(23)19(22)9-5-8-17-6-3-2-4-7-17/h2-4,6-7,10-13H,5,8-9,14-15H2,1H3,(H,21,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	126	n/a	n/a	n/a	n/a	n/a	n/a
Leiden University & Oncode Institute Curated by ChEMBL					Assay Description Inhibition of full-length C-terminal FLAG-tagged human PLAAT3 expressed in HEK293T cell lysate preincubated for 30 mins followed by MB064 addition an...				J Med Chem 63: 9340-9359 (2020)
					More data for this Ligand-Target Pair