Brief Information of the Compound and Protein
Compound Name
 Compound Info 
1-(2,6-Difluoro-benzyl)-5-{[methyl-(2-pyridin-2-yl-ethyl)-amino]-methyl}-6-(4-nitro-phenyl)-3-phenyl-1H-thieno[2,3-d]pyrimidine-2,4-dione
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 PubChem ID
CID: 44346397
Canonical SMILES
CN(CCc1ccccn1)Cc1c(sc2n(Cc3c(F)cccc3F)c(=O)n(-c3ccccc3)c(=O)c12)-c1ccc(cc1)[N+]([O-])=O
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Compound Formula C34H27F2N5O4S
Compound Structure
Protein Name
 Protein Info 
Gonadotropin-releasing hormone receptor
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
Peptide receptor (family A GPCR)
>
Short peptide receptor (family A GPCR)
>
GnRH receptor
Uniprot ID
P30968
Gene Name
GNRHR
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000053 COS-7
 Cell Line Info 
Chlorocebus aethiops (Green monkey)  14
1
IC50 = 40 nM
   TI
   LI
   LO
   TS
2
IC50 = 52 nM
   TI
   LI
   LO
   TS
3
IC50 = 58 nM
   TI
   LI
   LO
   TS
4
IC50 = 110 nM
   TI
   LI
   LO
   TS
5
IC50 = 200 nM
   TI
   LI
   LO
   TS
6
IC50 = 240 nM
   TI
   LI
   LO
   TS
7
IC50 = 400 nM
   TI
   LI
   LO
   TS
8
IC50 = 450 nM
   TI
   LI
   LO
   TS
9
IC50 = 900 nM
   TI
   LI
   LO
   TS
10
IC50 = 2000 nM
   TI
   LI
   LO
   TS
11
IC50 = 2650 nM
   TI
   LI
   LO
   TS
12
IC50 = 3600 nM
   TI
   LI
   LO
   TS
13
IC50 = 4500 nM
   TI
   LI
   LO
   TS
14
IC50 > 10000 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Ki = 0.6 nM