BDBM50164813 CHEMBL3797365

SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1cc(OC)cc(CC(C)C)n1

InChI Key InChIKey=AFNUABBHQNAIDY-FQEVSTJZSA-N

Data  2 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50164813   

TargetSphingosine 1-phosphate receptor 3(Homo sapiens (Human))
Actelion Pharmaceuticals Ltd

Curated by ChEMBL
LigandPNGBDBM50164813(CHEMBL3797365)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1cc(OC)cc(CC(C)C)n1
Show InChI InChI=1S/C26H34N4O6/c1-6-17-9-18(8-16(4)24(17)35-14-20(32)12-27-23(33)13-31)25-29-26(36-30-25)22-11-21(34-5)10-19(28-22)7-15(2)3/h8-11,15,20,31-32H,6-7,12-14H2,1-5H3,(H,27,33)/t20-/m0/s1
Affinity DataEC50:  1.40E+3nMAssay Description:Agonist activity at human recombinant S1PR3 expressed in CHO cell membranes incubated for 30 mins by [35S]GTPgammaS binding assay in presence of GDPMore data for this Ligand-Target Pair
TargetSphingosine 1-phosphate receptor 1(Homo sapiens (Human))
Actelion Pharmaceuticals Ltd

Curated by ChEMBL
LigandPNGBDBM50164813(CHEMBL3797365)
Show SMILES CCc1cc(cc(C)c1OC[C@@H](O)CNC(=O)CO)-c1noc(n1)-c1cc(OC)cc(CC(C)C)n1
Show InChI InChI=1S/C26H34N4O6/c1-6-17-9-18(8-16(4)24(17)35-14-20(32)12-27-23(33)13-31)25-29-26(36-30-25)22-11-21(34-5)10-19(28-22)7-15(2)3/h8-11,15,20,31-32H,6-7,12-14H2,1-5H3,(H,27,33)/t20-/m0/s1
Affinity DataEC50:  1.5nMAssay Description:Agonist activity at human recombinant S1PR1 expressed in CHO cell membranes incubated for 30 mins by [35S]GTPgammaS binding assay in presence of GDPMore data for this Ligand-Target Pair