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BDBM46792 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)propanenitrile::2-(1,3-dihydrobenzimidazol-2-ylidene)-3-(3,5-dimethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)propanenitrile::2-(1,3-dihydrobenzimidazol-2-ylidene)-3-(3,5-dimethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)propanenitrile::2-(1,3-dihydrobenzimidazol-2-ylidene)-3-(4-keto-3,5-dimethoxy-cyclohexa-2,5-dien-1-ylidene)propionitrile::MLS000716138::SMR000277655::cid_5335875

SMILES: COc1cc(C=C(C#N)c2nc3ccccc3[nH]2)cc(OC)c1O

InChI Key: InChIKey=ZDDQZHYZCTUTIU-UHFFFAOYSA-N

Data: 1 IC50  3 EC50

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 4 hits for monomerid = 46792   
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
transient receptor potential cation channel, subfamily N, member 1


(Danio rerio)
BDBM46792
PNG
(2-(1,3-dihydrobenzimidazol-2-ylidene)-3-(3,5-dimet...)
Show SMILES COc1cc(C=C(C#N)c2nc3ccccc3[nH]2)cc(OC)c1O
Show InChI InChI=1S/C18H15N3O3/c1-23-15-8-11(9-16(24-2)17(15)22)7-12(10-19)18-20-13-5-3-4-6-14(13)21-18/h3-9,22H,1-2H3,(H,20,21)
KEGG

UniProtKB/TrEMBL

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PCBioAssay
n/an/an/an/a 3.62E+3n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q28S4NBW
More data for this
Ligand-Target Pair
cardiac alpha tropomyosin


(Sus scrofa)
BDBM46792
PNG
(2-(1,3-dihydrobenzimidazol-2-ylidene)-3-(3,5-dimet...)
Show SMILES COc1cc(C=C(C#N)c2nc3ccccc3[nH]2)cc(OC)c1O
Show InChI InChI=1S/C18H15N3O3/c1-23-15-8-11(9-16(24-2)17(15)22)7-12(10-19)18-20-13-5-3-4-6-14(13)21-18/h3-9,22H,1-2H3,(H,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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n/an/an/an/a 4.89E+3n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q21N7ZKB
More data for this
Ligand-Target Pair
MCOLN3 protein


(Homo sapiens (Human))
BDBM46792
PNG
(2-(1,3-dihydrobenzimidazol-2-ylidene)-3-(3,5-dimet...)
Show SMILES COc1cc(C=C(C#N)c2nc3ccccc3[nH]2)cc(OC)c1O
Show InChI InChI=1S/C18H15N3O3/c1-23-15-8-11(9-16(24-2)17(15)22)7-12(10-19)18-20-13-5-3-4-6-14(13)21-18/h3-9,22H,1-2H3,(H,20,21)
PDB

KEGG

UniProtKB/SwissProt

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n/an/an/an/a 8.88E+3n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q22Z13Z2
More data for this
Ligand-Target Pair
eukaryotic translation initiation factor 4 gamma, 1 isoform 4


(Homo sapiens (Human))
BDBM46792
PNG
(2-(1,3-dihydrobenzimidazol-2-ylidene)-3-(3,5-dimet...)
Show SMILES COc1cc(C=C(C#N)c2nc3ccccc3[nH]2)cc(OC)c1O
Show InChI InChI=1S/C18H15N3O3/c1-23-15-8-11(9-16(24-2)17(15)22)7-12(10-19)18-20-13-5-3-4-6-14(13)21-18/h3-9,22H,1-2H3,(H,20,21)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
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n/an/a 5.00E+4n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
Dose Response Confirmation for Small Molecule Inhibitors of Eukaryotic Translation Initiation NIH Molecular Libraries Screening Centers Network [MLSC...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2RN3686
More data for this
Ligand-Target Pair