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SMILES: CC(C)Oc1ccc(cc1C)-c1cn(nn1)-c1ccc2CC(N)(CO)CCc2c1

InChI Key: InChIKey=DBUZIKAUDIZNHO-UHFFFAOYSA-N

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 3 hits for monomerid = 221929   
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 1


(Homo sapiens (Human))
BDBM221929
PNG
(US9315492, 31 | US9315492, 32)
Show SMILES CC(C)Oc1ccc(cc1C)-c1cn(nn1)-c1ccc2CC(N)(CO)CCc2c1
Show InChI InChI=1S/C23H28N4O2/c1-15(2)29-22-7-5-18(10-16(22)3)21-13-27(26-25-21)20-6-4-19-12-23(24,14-28)9-8-17(19)11-20/h4-7,10-11,13,15,28H,8-9,12,14,24H2,1-3H3
PDB

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UniProtKB/SwissProt

B.MOAD
antibodypedia
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PC cid
PC sid
UniChem
US Patent
n/an/a 5n/an/an/an/a7.4n/a



Beijing Foreland Biopharma Co., Ltd.

US Patent


Assay Description
Test method: wetting membranes by saponin solution, and preparing [35S]-GTPγS in binding solution (4×). The test compound was prepared as 4× of ...


US Patent US9315492 (2016)


BindingDB Entry DOI: 10.7270/Q2154FW6
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Mus musculus (Mouse))
BDBM221929
PNG
(US9315492, 31 | US9315492, 32)
Show SMILES CC(C)Oc1ccc(cc1C)-c1cn(nn1)-c1ccc2CC(N)(CO)CCc2c1
Show InChI InChI=1S/C23H28N4O2/c1-15(2)29-22-7-5-18(10-16(22)3)21-13-27(26-25-21)20-6-4-19-12-23(24,14-28)9-8-17(19)11-20/h4-7,10-11,13,15,28H,8-9,12,14,24H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 14.3n/an/an/a25



Beijing Foreland Biopharma Co., Ltd.

US Patent


Assay Description
Assay procedures: OCC culture solution was preheated in water tank at 37° C. Cells were taken out from liquor nitrogen tank, left on the dry-ice, and...


US Patent US9315492 (2016)


BindingDB Entry DOI: 10.7270/Q2154FW6
More data for this
Ligand-Target Pair
Sphingosine 1-phosphate receptor 1


(Homo sapiens (Human))
BDBM221929
PNG
(US9315492, 31 | US9315492, 32)
Show SMILES CC(C)Oc1ccc(cc1C)-c1cn(nn1)-c1ccc2CC(N)(CO)CCc2c1
Show InChI InChI=1S/C23H28N4O2/c1-15(2)29-22-7-5-18(10-16(22)3)21-13-27(26-25-21)20-6-4-19-12-23(24,14-28)9-8-17(19)11-20/h4-7,10-11,13,15,28H,8-9,12,14,24H2,1-3H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 125n/an/an/an/a7.4n/a



Beijing Foreland Biopharma Co., Ltd.

US Patent


Assay Description
Test method: wetting membranes by saponin solution, and preparing [35S]-GTPγS in binding solution (4×). The test compound was prepared as 4× of ...


US Patent US9315492 (2016)


BindingDB Entry DOI: 10.7270/Q2154FW6
More data for this
Ligand-Target Pair