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BDBM46679 (4-chlorodithiazol-5-ylidene)-(2,5-dimethoxyphenyl)amine::4-chloranyl-N-(2,5-dimethoxyphenyl)-1,2,3-dithiazol-5-imine::4-chloro-N-(2,5-dimethoxyphenyl)-5-dithiazolimine::4-chloro-N-(2,5-dimethoxyphenyl)dithiazol-5-imine::MLS-0390822.0001::cid_483894

SMILES: COc1ccc(OC)c(c1)\N=c1\ssnc1Cl

InChI Key: InChIKey=DXMBBLQZGMHXSZ-ZRDIBKRKSA-N

Data: 5 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 5 hits for monomerid = 46679   
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
phosphomannomutase 2


(Homo sapiens (Human))
BDBM46679
PNG
((4-chlorodithiazol-5-ylidene)-(2,5-dimethoxyphenyl...)
Show SMILES COc1ccc(OC)c(c1)\N=c1\ssnc1Cl
Show InChI InChI=1S/C10H9ClN2O2S2/c1-14-6-3-4-8(15-2)7(5-6)12-10-9(11)13-17-16-10/h3-5H,1-2H3/b12-10+
PDB
MMDB

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PC cid
PC sid
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PCBioAssay
n/an/a>1.00E+5n/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/Q2CJ8BWC
More data for this
Ligand-Target Pair
MPI protein


(Homo sapiens (Human))
BDBM46679
PNG
((4-chlorodithiazol-5-ylidene)-(2,5-dimethoxyphenyl...)
Show SMILES COc1ccc(OC)c(c1)\N=c1\ssnc1Cl
Show InChI InChI=1S/C10H9ClN2O2S2/c1-14-6-3-4-8(15-2)7(5-6)12-10-9(11)13-17-16-10/h3-5H,1-2H3/b12-10+
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n/an/a 4.35E+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/Q2J964TC
More data for this
Ligand-Target Pair
probable DNA dC->dU-editing enzyme APOBEC-3A


(Homo sapiens (Human))
BDBM46679
PNG
((4-chlorodithiazol-5-ylidene)-(2,5-dimethoxyphenyl...)
Show SMILES COc1ccc(OC)c(c1)\N=c1\ssnc1Cl
Show InChI InChI=1S/C10H9ClN2O2S2/c1-14-6-3-4-8(15-2)7(5-6)12-10-9(11)13-17-16-10/h3-5H,1-2H3/b12-10+
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
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UniChem

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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/Q2CZ35ND
More data for this
Ligand-Target Pair
DNA dC->dU-editing enzyme APOBEC-3G


(Homo sapiens (Human))
BDBM46679
PNG
((4-chlorodithiazol-5-ylidene)-(2,5-dimethoxyphenyl...)
Show SMILES COc1ccc(OC)c(c1)\N=c1\ssnc1Cl
Show InChI InChI=1S/C10H9ClN2O2S2/c1-14-6-3-4-8(15-2)7(5-6)12-10-9(11)13-17-16-10/h3-5H,1-2H3/b12-10+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.54E+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/Q2HQ3XD6
More data for this
Ligand-Target Pair
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM46679
PNG
((4-chlorodithiazol-5-ylidene)-(2,5-dimethoxyphenyl...)
Show SMILES COc1ccc(OC)c(c1)\N=c1\ssnc1Cl
Show InChI InChI=1S/C10H9ClN2O2S2/c1-14-6-3-4-8(15-2)7(5-6)12-10-9(11)13-17-16-10/h3-5H,1-2H3/b12-10+
PDB
MMDB

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UniChem

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PCBioAssay
n/an/a 2.10E+4n/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, CA...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2F18X6W
More data for this
Ligand-Target Pair