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SMILES: OC(=O)CCCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)cc1

InChI Key: InChIKey=DWEYWOYWLZCIKF-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 195890   
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 5


(Homo sapiens (Human))
BDBM195890
PNG
(US9670220, 35)
Show SMILES OC(=O)CCCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)cc1
Show InChI InChI=1S/C24H24FNO4/c25-21-5-2-1-4-18(21)16-29-20-9-7-17(8-10-20)23-14-19-15-26(12-3-6-24(27)28)13-11-22(19)30-23/h1-2,4-5,7-10,14H,3,6,11-13,15-16H2,(H,27,28)
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UniProtKB/SwissProt

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PC cid
PC sid
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US Patent
n/an/an/an/a 5n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P5-Aeqorin assay was bought from Euroscreen, Brussels (Euroscreen, Technical dossier, Human Lysophospholid S1P5 (Edg8) receptor, DNA ...


US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 3


(Homo sapiens (Human))
BDBM195890
PNG
(US9670220, 35)
Show SMILES OC(=O)CCCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)cc1
Show InChI InChI=1S/C24H24FNO4/c25-21-5-2-1-4-18(21)16-29-20-9-7-17(8-10-20)23-14-19-15-26(12-3-6-24(27)28)13-11-22(19)30-23/h1-2,4-5,7-10,14H,3,6,11-13,15-16H2,(H,27,28)
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US Patent
n/an/an/an/a 5.00E+3n/an/an/an/a



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-human-S1P3-Aeqorin assay (CHO/Gα16/AEQ/h-S1P3) was established at Solvay Pharmaceuticals. The plasmid DNA coding for the S1P3 receptor (...


US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM195890
PNG
(US9670220, 35)
Show SMILES OC(=O)CCCN1CCc2oc(cc2C1)-c1ccc(OCc2ccccc2F)cc1
Show InChI InChI=1S/C24H24FNO4/c25-21-5-2-1-4-18(21)16-29-20-9-7-17(8-10-20)23-14-19-15-26(12-3-6-24(27)28)13-11-22(19)30-23/h1-2,4-5,7-10,14H,3,6,11-13,15-16H2,(H,27,28)
PDB

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B.MOAD
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 250n/an/an/a25



Abbvie B.V.; AbbiVie Inc.

US Patent


Assay Description
The CHO-K1-Human S1P1-c-AMP assay was performed at Euroscreenfast, Brussels (Euroscreen, Human S1P1 coupling Gi/0, (Edg1) receptor, catalog no: FAST-...


US Patent US9670220 (2017)


BindingDB Entry DOI: 10.7270/Q2QJ7FHD
More data for this
Ligand-Target Pair