BDBM50033092 CHEMBL3342962

SMILES: OC(=O)CCCN1CC(Oc2c(NC(=O)c3ccc(OCCCCOc4ccccc4)cc3)cccc12)C(O)=O

InChI Key: InChIKey=IRNLQQDWCBJNCF-UHFFFAOYSA-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 = 50033092   

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
Cysteinyl leukotriene receptor (Homo sapiens (Human))	BDBM50033092 (CHEMBL3342962) Show SMILES OC(=O)CCCN1CC(Oc2c(NC(=O)c3ccc(OCCCCOc4ccccc4)cc3)cccc12)C(O)=O Show InChI InChI=1S/C30H32N2O8/c33-27(34)12-7-17-32-20-26(30(36)37)40-28-24(10-6-11-25(28)32)31-29(35)21-13-15-23(16-14-21)39-19-5-4-18-38-22-8-2-1-3-9-22/h1-3,6,8-11,13-16,26H,4-5,7,12,17-20H2,(H,31,35)(H,33,34)(H,36,37)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Ono Pharmaceutical Co., Ltd. Curated by ChEMBL					Assay Description Antagonist activity at human CysLT1 receptor expressed in CHO cells assessed as inhibition of LTD4-inudced intracellular calcium influx preincubated ...				ACS Med Chem Lett 5: 1230-4 (2014) Article DOI: 10.1021/ml500298y BindingDB Entry DOI: 10.7270/Q2QV3P3H
					More data for this Ligand-Target Pair
CYSLTR2 (Homo sapiens (Human))	BDBM50033092 (CHEMBL3342962) Show SMILES OC(=O)CCCN1CC(Oc2c(NC(=O)c3ccc(OCCCCOc4ccccc4)cc3)cccc12)C(O)=O Show InChI InChI=1S/C30H32N2O8/c33-27(34)12-7-17-32-20-26(30(36)37)40-28-24(10-6-11-25(28)32)31-29(35)21-13-15-23(16-14-21)39-19-5-4-18-38-22-8-2-1-3-9-22/h1-3,6,8-11,13-16,26H,4-5,7,12,17-20H2,(H,31,35)(H,33,34)(H,36,37)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Ono Pharmaceutical Co., Ltd. Curated by ChEMBL					Assay Description Antagonist activity at human CysLT2 receptor expressed in HEK293 cells assessed as inhibition of LTD4-inudced intracellular calcium influx preincubat...				ACS Med Chem Lett 5: 1230-4 (2014) Article DOI: 10.1021/ml500298y BindingDB Entry DOI: 10.7270/Q2QV3P3H
					More data for this Ligand-Target Pair