BDBM50025103 CHEMBL41301::Sodium; 4-{4-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)-propylsulfanyl]-phenyl}-4-hydroxy-3-methyl-butyrate

SMILES: CCCc1c(O)c(ccc1OCCCSc1ccc(cc1)C(O)[C@@H](C)CC([O-])=O)C(C)=O

InChI Key: InChIKey=YNHQJUJPBNEXHQ-FXIRQEPWSA-M

Data: 2 KI

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 = 50025103   

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 1 (GUINEA PIG)	BDBM50025103 (CHEMBL41301 | Sodium; 4-{4-[3-(4-acetyl-3-hydroxy-...) Show SMILES CCCc1c(O)c(ccc1OCCCSc1ccc(cc1)C(O)[C@@H](C)CC([O-])=O)C(C)=O Show InChI InChI=1S/C25H32O6S/c1-4-6-21-22(12-11-20(17(3)26)25(21)30)31-13-5-14-32-19-9-7-18(8-10-19)24(29)16(2)15-23(27)28/h7-12,16,24,29-30H,4-6,13-15H2,1-3H3,(H,27,28)/p-1/t16-,24?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of radioligand [3H]-LTD4 binding to Cysteinyl leukotriene D4 receptor in guinea pig lung membranes				J Med Chem 29: 1573-6 (1986) BindingDB Entry DOI: 10.7270/Q21G0K8C
					More data for this Ligand-Target Pair
Cysteinyl leukotriene receptor 1 (GUINEA PIG)	BDBM50025103 (CHEMBL41301 | Sodium; 4-{4-[3-(4-acetyl-3-hydroxy-...) Show SMILES CCCc1c(O)c(ccc1OCCCSc1ccc(cc1)C(O)[C@@H](C)CC([O-])=O)C(C)=O Show InChI InChI=1S/C25H32O6S/c1-4-6-21-22(12-11-20(17(3)26)25(21)30)31-13-5-14-32-19-9-7-18(8-10-19)24(29)16(2)15-23(27)28/h7-12,16,24,29-30H,4-6,13-15H2,1-3H3,(H,27,28)/p-1/t16-,24?/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for inhibition of radioligand [3H]-LTC4 binding to Cysteinyl leukotriene D4 receptor in guinea pig lung membranes				J Med Chem 29: 1573-6 (1986) BindingDB Entry DOI: 10.7270/Q21G0K8C
					More data for this Ligand-Target Pair