BDBM43258 2-[(3S,3'aR,8'aS,8'bS)-5,7-dimethyl-1',2,3'-trioxo-2'-spiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]yl]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester::2-[(3aR,4S,8aS,8bS)-1,2',3-triketo-5',7'-dimethyl-spiro[3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine-4,3'-indoline]-2-yl]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester::MLS000580390::SMR000220594::cid_16189657::methyl 2-[(3S,3'aR,8'aS,8'bS)-5,7-dimethyl-1',2,3'-trioxospiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-2'-yl]-4,5-dimethylthiophene-3-carboxylate::methyl 2-[(3S,3'aR,8'aS,8'bS)-5,7-dimethyl-1',2,3'-tris(oxidanylidene)spiro[1H-indole-3,4'-3a,6,7,8,8a,8b-hexahydropyrrolo[3,4-a]pyrrolizine]-2'-yl]-4,5-dimethyl-thiophene-3-carboxylate

SMILES COC(=O)c1c(C)c(C)sc1-n1c(O)c2[C@@H]3CCCN3[C@@]3(C(=O)Nc4c3cc(C)cc4C)c2c1O

InChI Key InChIKey=VJSITLCSQVWBRH-UHFFFAOYSA-N

Data  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 43258   

TargetRas-related protein Rab-2A(Dog)
Nmmlsc

Curated by PubChem BioAssay
LigandPNGBDBM43258(2-[(3S,3'aR,8'aS,8'bS)-5,7-dimethyl-1',2,3'-trioxo...)
Affinity DataEC50:  1.99E+3nMAssay Description:University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/20/2011
Entry Details
PCBioAssay