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SMILES: CC(NC(=O)C(=C\c1c(C)[nH]c2ccccc12)\C#N)c1ccccc1

InChI Key: InChIKey=IZOMIQZNOSWCMY-SFQUDFHCSA-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 2 hits for monomerid = 80413   
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
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM80413
PNG
((E)-2-cyano-3-(2-methyl-1H-indol-3-yl)-N-(1-phenyl...)
Show SMILES CC(NC(=O)C(=C\c1c(C)[nH]c2ccccc12)\C#N)c1ccccc1
Show InChI InChI=1S/C21H19N3O/c1-14(16-8-4-3-5-9-16)24-21(25)17(13-22)12-19-15(2)23-20-11-7-6-10-18(19)20/h3-12,14,23H,1-2H3,(H,24,25)/b17-12+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.64E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2862DX0
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3A


(Homo sapiens (Human))
BDBM80413
PNG
((E)-2-cyano-3-(2-methyl-1H-indol-3-yl)-N-(1-phenyl...)
Show SMILES CC(NC(=O)C(=C\c1c(C)[nH]c2ccccc12)\C#N)c1ccccc1
Show InChI InChI=1S/C21H19N3O/c1-14(16-8-4-3-5-9-16)24-21(25)17(13-22)12-19-15(2)23-20-11-7-6-10-18(19)20/h3-12,14,23H,1-2H3,(H,24,25)/b17-12+
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.87E+3n/an/an/an/an/a25



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q24F1P6P
More data for this
Ligand-Target Pair