BindingDB logo
myBDB logout

3 similar compounds to monomer 237

Compile data set for download or QSAR
Wt: 249.3
BDBM39780
Purchase
Wt: 263.3
BDBM61635
Purchase
Wt: 289.3
BDBM61634

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 11 hits for monomerid = 39780,61635,61634   
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
Alkaline phosphatase placental-like


(Homo sapiens (Human))
BDBM39780
PNG
(1-Methyl-4-[2-(2-methyl-1H-indol-3-yl)-vinyl]-pyri...)
Show SMILES Cc1[nH]c2ccccc2c1\C=C\c1cc[n+](C)cc1
Show InChI InChI=1S/C17H16N2/c1-13-15(16-5-3-4-6-17(16)18-13)8-7-14-9-11-19(2)12-10-14/h3-12H,1-2H3/p+1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.91E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2MS3R5M
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens (Human))
BDBM61634
PNG
(1-allyl-2-methyl-3-[(E)-2-(1-methylpyridin-1-ium-4...)
Show SMILES Cc1c(\C=C\c2cc[n+](C)cc2)c2ccccc2n1CC=C
Show InChI InChI=1S/C20H21N2/c1-4-13-22-16(2)18(19-7-5-6-8-20(19)22)10-9-17-11-14-21(3)15-12-17/h4-12,14-15H,1,13H2,2-3H3/q+1
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.97E+3n/an/an/an/an/an/a



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 (2010)


BindingDB Entry DOI: 10.7270/Q2TQ5ZZB
More data for this
Ligand-Target Pair
G-protein coupled receptor 35


(Homo sapiens (Human))
BDBM61635
PNG
(2,5-dimethyl-3-[(E)-2-(1-methyl-4-pyridin-1-iumyl)...)
Show SMILES Cc1[nH]c2ccc(C)cc2c1\C=C\c1cc[n+](C)cc1
Show InChI InChI=1S/C18H18N2/c1-13-4-7-18-17(12-13)16(14(2)19-18)6-5-15-8-10-20(3)11-9-15/h4-12H,1-3H3/p+1
KEGG

UniProtKB/SwissProt

GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.62E+3n/an/an/an/an/an/a



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 (2010)


BindingDB Entry DOI: 10.7270/Q2TQ5ZZB
More data for this
Ligand-Target Pair
Alkaline phosphatase placental-like


(Homo sapiens (Human))
BDBM39780
PNG
(1-Methyl-4-[2-(2-methyl-1H-indol-3-yl)-vinyl]-pyri...)
Show SMILES Cc1[nH]c2ccccc2c1\C=C\c1cc[n+](C)cc1
Show InChI InChI=1S/C17H16N2/c1-13-15(16-5-3-4-6-17(16)18-13)8-7-14-9-11-19(2)12-10-14/h3-12H,1-2H3/p+1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

Article
PCBioAssay
n/an/an/an/a 9.99E+5n/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...


PubChem Bioassay (2007)


Article DOI: 10.1016/j.bioorg.2013.06.006
BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
G-protein coupled receptor 55


(Homo sapiens (Human))
BDBM61635
PNG
(2,5-dimethyl-3-[(E)-2-(1-methyl-4-pyridin-1-iumyl)...)
Show SMILES Cc1[nH]c2ccc(C)cc2c1\C=C\c1cc[n+](C)cc1
Show InChI InChI=1S/C18H18N2/c1-13-4-7-18-17(12-13)16(14(2)19-18)6-5-15-8-10-20(3)11-9-15/h4-12H,1-3H3/p+1
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.57E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


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


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2028PZ5
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM61634
PNG
(1-allyl-2-methyl-3-[(E)-2-(1-methylpyridin-1-ium-4...)
Show SMILES Cc1c(\C=C\c2cc[n+](C)cc2)c2ccccc2n1CC=C
Show InChI InChI=1S/C20H21N2/c1-4-13-22-16(2)18(19-7-5-6-8-20(19)22)10-9-17-11-14-21(3)15-12-17/h4-12,14-15H,1,13H2,2-3H3/q+1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.63E+4n/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
nucleotide-binding oligomerization domain containing 1


(Homo sapiens (Human))
BDBM61635
PNG
(2,5-dimethyl-3-[(E)-2-(1-methyl-4-pyridin-1-iumyl)...)
Show SMILES Cc1[nH]c2ccc(C)cc2c1\C=C\c1cc[n+](C)cc1
Show InChI InChI=1S/C18H18N2/c1-13-4-7-18-17(12-13)16(14(2)19-18)6-5-15-8-10-20(3)11-9-15/h4-12H,1-3H3/p+1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.36E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute Network: NIH Molecular Lib...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2F47MKR
More data for this
Ligand-Target Pair
nucleotide-binding oligomerization domain containing 1


(Homo sapiens (Human))
BDBM61634
PNG
(1-allyl-2-methyl-3-[(E)-2-(1-methylpyridin-1-ium-4...)
Show SMILES Cc1c(\C=C\c2cc[n+](C)cc2)c2ccccc2n1CC=C
Show InChI InChI=1S/C20H21N2/c1-4-13-22-16(2)18(19-7-5-6-8-20(19)22)10-9-17-11-14-21(3)15-12-17/h4-12,14-15H,1,13H2,2-3H3/q+1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 4.99E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics Source Affiliation: Sanford-Burnham Medical Research Institute Network: NIH Molecular Lib...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2F47MKR
More data for this
Ligand-Target Pair
probable DNA dC->dU-editing enzyme APOBEC-3A


(Homo sapiens (Human))
BDBM61634
PNG
(1-allyl-2-methyl-3-[(E)-2-(1-methylpyridin-1-ium-4...)
Show SMILES Cc1c(\C=C\c2cc[n+](C)cc2)c2ccccc2n1CC=C
Show InChI InChI=1S/C20H21N2/c1-4-13-22-16(2)18(19-7-5-6-8-20(19)22)10-9-17-11-14-21(3)15-12-17/h4-12,14-15H,1,13H2,2-3H3/q+1
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>1.00E+5n/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
cardiac alpha tropomyosin


(Sus scrofa)
BDBM61634
PNG
(1-allyl-2-methyl-3-[(E)-2-(1-methylpyridin-1-ium-4...)
Show SMILES Cc1c(\C=C\c2cc[n+](C)cc2)c2ccccc2n1CC=C
Show InChI InChI=1S/C20H21N2/c1-4-13-22-16(2)18(19-7-5-6-8-20(19)22)10-9-17-11-14-21(3)15-12-17/h4-12,14-15H,1,13H2,2-3H3/q+1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 1.88E+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) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q21N7ZKB
More data for this
Ligand-Target Pair
G-protein coupled receptor 55


(Homo sapiens (Human))
BDBM61634
PNG
(1-allyl-2-methyl-3-[(E)-2-(1-methylpyridin-1-ium-4...)
Show SMILES Cc1c(\C=C\c2cc[n+](C)cc2)c2ccccc2n1CC=C
Show InChI InChI=1S/C20H21N2/c1-4-13-22-16(2)18(19-7-5-6-8-20(19)22)10-9-17-11-14-21(3)15-12-17/h4-12,14-15H,1,13H2,2-3H3/q+1
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.79E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


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


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2028PZ5
More data for this
Ligand-Target Pair