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BDBM50203733 CHEMBL3979157

SMILES: Fc1ccc(cc1)C(=O)N1CCC(F)(F)C(C1)Oc1ccc2ccccc2n1

InChI Key: InChIKey=VKQHUBNARZWDMS-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50203733   
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
Orexin receptor type 2


(Homo sapiens (Human))
BDBM50203733
PNG
(CHEMBL3979157)
Show SMILES Fc1ccc(cc1)C(=O)N1CCC(F)(F)C(C1)Oc1ccc2ccccc2n1
Show InChI InChI=1S/C21H17F3N2O2/c22-16-8-5-15(6-9-16)20(27)26-12-11-21(23,24)18(13-26)28-19-10-7-14-3-1-2-4-17(14)25-19/h1-10,18H,11-13H2
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Similars

Article
PubMed
>4.38E+3n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of (2S)-N-(2-pyrrol-1-ylphenyl)-1-[2-[1-(tritritiomethyl)benzimidazol-2-yl]sulfanylacetyl]pyrrolidine-2-carboxamide from human OX2 recep...


Bioorg Med Chem Lett 26: 5809-5814 (2016)


Article DOI: 10.1016/j.bmcl.2016.10.019
BindingDB Entry DOI: 10.7270/Q2MS3VRG
More data for this
Ligand-Target Pair