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BDBM94812 (E)-2-cyano-3-[2-(diethylamino)-7-methyl-3-quinolinyl]-2-propenamide::(E)-2-cyano-3-[2-(diethylamino)-7-methyl-3-quinolyl]acrylamide::(E)-2-cyano-3-[2-(diethylamino)-7-methyl-quinolin-3-yl]prop-2-enamide::(E)-2-cyano-3-[2-(diethylamino)-7-methylquinolin-3-yl]prop-2-enamide::MLS001017651::SMR000353918::cid_6176893

SMILES: CCN(CC)c1nc2cc(C)ccc2cc1\C=C(/C#N)C(N)=O

InChI Key: InChIKey=SYPLOYPHKMSNCI-XNTDXEJSSA-N

Data: 2 IC50

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 = 94812   
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
sentrin-specific protease 1


(Homo sapiens (Human))
BDBM94812
PNG
((E)-2-cyano-3-[2-(diethylamino)-7-methyl-3-quinoli...)
Show SMILES CCN(CC)c1nc2cc(C)ccc2cc1\C=C(/C#N)C(N)=O
Show InChI InChI=1S/C18H20N4O/c1-4-22(5-2)18-14(10-15(11-19)17(20)23)9-13-7-6-12(3)8-16(13)21-18/h6-10H,4-5H2,1-3H3,(H2,20,23)/b15-10+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.73E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2MC8XNQ
More data for this
Ligand-Target Pair
sentrin-specific protease 1


(Homo sapiens (Human))
BDBM94812
PNG
((E)-2-cyano-3-[2-(diethylamino)-7-methyl-3-quinoli...)
Show SMILES CCN(CC)c1nc2cc(C)ccc2cc1\C=C(/C#N)C(N)=O
Show InChI InChI=1S/C18H20N4O/c1-4-22(5-2)18-14(10-15(11-19)17(20)23)9-13-7-6-12(3)8-16(13)21-18/h6-10H,4-5H2,1-3H3,(H2,20,23)/b15-10+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2R49PCF
More data for this
Ligand-Target Pair