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BDBM103616 US8563594, 166

SMILES: Oc1ccc2n(Cc3ccccc3)c(C3CCCC3)c(C(=O)NCc3ccc(F)c(F)c3)c2c1

InChI Key: InChIKey=ACJAPISBRPGZRJ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 103616   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM103616
PNG
(US8563594, 166)
Show SMILES Oc1ccc2n(Cc3ccccc3)c(C3CCCC3)c(C(=O)NCc3ccc(F)c(F)c3)c2c1
Show InChI InChI=1S/C28H26F2N2O2/c29-23-12-10-19(14-24(23)30)16-31-28(34)26-22-15-21(33)11-13-25(22)32(17-18-6-2-1-3-7-18)27(26)20-8-4-5-9-20/h1-3,6-7,10-15,20,33H,4-5,8-9,16-17H2,(H,31,34)
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 31n/an/an/an/an/an/a



Allergan Inc

US Patent


Assay Description
FLIPR assay using S1P3 receptor inhibitor.


US Patent US8563594 (2013)


BindingDB Entry DOI: 10.7270/Q2765CZV
More data for this
Ligand-Target Pair