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BDBM52287 4-[3-(5-Furan-2-yl-2H-pyrazol-3-yl)-5-mercapto-[1,2,4]triazol-4-yl]-benzoic acid::4-[3-[5-(2-furanyl)-1H-pyrazol-3-yl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzoic acid::4-[3-[5-(2-furyl)-1H-pyrazol-3-yl]-5-thioxo-1H-1,2,4-triazol-4-yl]benzoic acid::4-[3-[5-(furan-2-yl)-1H-pyrazol-3-yl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]benzoic acid::MLS000551487::SMR000145412::cid_1839198

SMILES: OC(=O)c1ccc(cc1)-n1c(n[nH]c1=S)-c1cc([nH]n1)-c1ccco1

InChI Key: InChIKey=IEPBFGDXTHAEIK-UHFFFAOYSA-N

Data: 9 IC50  2 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 11 hits for monomerid = 52287   
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
POsterior Segregation family member (pos-1)


(Caenorhabditis elegans)
BDBM52287
PNG
(4-[3-(5-Furan-2-yl-2H-pyrazol-3-yl)-5-mercapto-[1,...)
Show SMILES OC(=O)c1ccc(cc1)-n1c(n[nH]c1=S)-c1cc([nH]n1)-c1ccco1
Show InChI InChI=1S/C16H11N5O3S/c22-15(23)9-3-5-10(6-4-9)21-14(19-20-16(21)25)12-8-11(17-18-12)13-2-1-7-24-13/h1-8H,(H,17,18)(H,20,25)(H,22,23)
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n/an/an/an/a 4.19E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q28G8J4C
More data for this
Ligand-Target Pair
RecName: Full=Zinc finger protein mex-5


(Caenorhabditis elegans)
BDBM52287
PNG
(4-[3-(5-Furan-2-yl-2H-pyrazol-3-yl)-5-mercapto-[1,...)
Show SMILES OC(=O)c1ccc(cc1)-n1c(n[nH]c1=S)-c1cc([nH]n1)-c1ccco1
Show InChI InChI=1S/C16H11N5O3S/c22-15(23)9-3-5-10(6-4-9)21-14(19-20-16(21)25)12-8-11(17-18-12)13-2-1-7-24-13/h1-8H,(H,17,18)(H,20,25)(H,22,23)
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n/an/an/an/a 4.74E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2D798VP
More data for this
Ligand-Target Pair
Glucose 6-phosphate dehydrogenase (G6PD)


(Homo sapiens (Human))
BDBM52287
PNG
(4-[3-(5-Furan-2-yl-2H-pyrazol-3-yl)-5-mercapto-[1,...)
Show SMILES OC(=O)c1ccc(cc1)-n1c(n[nH]c1=S)-c1cc([nH]n1)-c1ccco1
Show InChI InChI=1S/C16H11N5O3S/c22-15(23)9-3-5-10(6-4-9)21-14(19-20-16(21)25)12-8-11(17-18-12)13-2-1-7-24-13/h1-8H,(H,17,18)(H,20,25)(H,22,23)
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n/an/a>8.00E+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 (2011)


BindingDB Entry DOI: 10.7270/Q2V12389
More data for this
Ligand-Target Pair
glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase


(Plasmodium falciparum 3D7)
BDBM52287
PNG
(4-[3-(5-Furan-2-yl-2H-pyrazol-3-yl)-5-mercapto-[1,...)
Show SMILES OC(=O)c1ccc(cc1)-n1c(n[nH]c1=S)-c1cc([nH]n1)-c1ccco1
Show InChI InChI=1S/C16H11N5O3S/c22-15(23)9-3-5-10(6-4-9)21-14(19-20-16(21)25)12-8-11(17-18-12)13-2-1-7-24-13/h1-8H,(H,17,18)(H,20,25)(H,22,23)
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n/an/a 2.75E+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 (2011)


BindingDB Entry DOI: 10.7270/Q2ZS2TZG
More data for this
Ligand-Target Pair
glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase


(Plasmodium falciparum 3D7)
BDBM52287
PNG
(4-[3-(5-Furan-2-yl-2H-pyrazol-3-yl)-5-mercapto-[1,...)
Show SMILES OC(=O)c1ccc(cc1)-n1c(n[nH]c1=S)-c1cc([nH]n1)-c1ccco1
Show InChI InChI=1S/C16H11N5O3S/c22-15(23)9-3-5-10(6-4-9)21-14(19-20-16(21)25)12-8-11(17-18-12)13-2-1-7-24-13/h1-8H,(H,17,18)(H,20,25)(H,22,23)
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n/an/a>8.00E+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 (2011)


BindingDB Entry DOI: 10.7270/Q27H1H3W
More data for this
Ligand-Target Pair
Phospholipase C-beta-3


(Homo sapiens (Human))
BDBM52287
PNG
(4-[3-(5-Furan-2-yl-2H-pyrazol-3-yl)-5-mercapto-[1,...)
Show SMILES OC(=O)c1ccc(cc1)-n1c(n[nH]c1=S)-c1cc([nH]n1)-c1ccco1
Show InChI InChI=1S/C16H11N5O3S/c22-15(23)9-3-5-10(6-4-9)21-14(19-20-16(21)25)12-8-11(17-18-12)13-2-1-7-24-13/h1-8H,(H,17,18)(H,20,25)(H,22,23)
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n/an/a 1.22E+5n/an/an/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 Ass...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2S46QKQ
More data for this
Ligand-Target Pair
carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 isoform 1


(Homo sapiens (Human))
BDBM52287
PNG
(4-[3-(5-Furan-2-yl-2H-pyrazol-3-yl)-5-mercapto-[1,...)
Show SMILES OC(=O)c1ccc(cc1)-n1c(n[nH]c1=S)-c1cc([nH]n1)-c1ccco1
Show InChI InChI=1S/C16H11N5O3S/c22-15(23)9-3-5-10(6-4-9)21-14(19-20-16(21)25)12-8-11(17-18-12)13-2-1-7-24-13/h1-8H,(H,17,18)(H,20,25)(H,22,23)
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n/an/a 1.60E+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 (2011)


BindingDB Entry DOI: 10.7270/Q2V986KM
More data for this
Ligand-Target Pair
Phospholipase C, gamma 1


(Homo sapiens (Human))
BDBM52287
PNG
(4-[3-(5-Furan-2-yl-2H-pyrazol-3-yl)-5-mercapto-[1,...)
Show SMILES OC(=O)c1ccc(cc1)-n1c(n[nH]c1=S)-c1cc([nH]n1)-c1ccco1
Show InChI InChI=1S/C16H11N5O3S/c22-15(23)9-3-5-10(6-4-9)21-14(19-20-16(21)25)12-8-11(17-18-12)13-2-1-7-24-13/h1-8H,(H,17,18)(H,20,25)(H,22,23)
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n/an/a 1.02E+5n/an/an/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 Ass...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2NC5ZV0
More data for this
Ligand-Target Pair
lens epithelium-derived growth factor p75


(Homo sapiens (Human))
BDBM52287
PNG
(4-[3-(5-Furan-2-yl-2H-pyrazol-3-yl)-5-mercapto-[1,...)
Show SMILES OC(=O)c1ccc(cc1)-n1c(n[nH]c1=S)-c1cc([nH]n1)-c1ccco1
Show InChI InChI=1S/C16H11N5O3S/c22-15(23)9-3-5-10(6-4-9)21-14(19-20-16(21)25)12-8-11(17-18-12)13-2-1-7-24-13/h1-8H,(H,17,18)(H,20,25)(H,22,23)
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n/an/a 5.37E+4n/an/an/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: Ohio State University Assay Provider: Mam...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2Q52N9H
More data for this
Ligand-Target Pair
lens epithelium-derived growth factor p75


(Homo sapiens (Human))
BDBM52287
PNG
(4-[3-(5-Furan-2-yl-2H-pyrazol-3-yl)-5-mercapto-[1,...)
Show SMILES OC(=O)c1ccc(cc1)-n1c(n[nH]c1=S)-c1cc([nH]n1)-c1ccco1
Show InChI InChI=1S/C16H11N5O3S/c22-15(23)9-3-5-10(6-4-9)21-14(19-20-16(21)25)12-8-11(17-18-12)13-2-1-7-24-13/h1-8H,(H,17,18)(H,20,25)(H,22,23)
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n/an/a 7.32E+3n/an/an/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: Ohio State University Assay Provider: Mam...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2KD1WKS
More data for this
Ligand-Target Pair
glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase


(Plasmodium falciparum 3D7)
BDBM52287
PNG
(4-[3-(5-Furan-2-yl-2H-pyrazol-3-yl)-5-mercapto-[1,...)
Show SMILES OC(=O)c1ccc(cc1)-n1c(n[nH]c1=S)-c1cc([nH]n1)-c1ccco1
Show InChI InChI=1S/C16H11N5O3S/c22-15(23)9-3-5-10(6-4-9)21-14(19-20-16(21)25)12-8-11(17-18-12)13-2-1-7-24-13/h1-8H,(H,17,18)(H,20,25)(H,22,23)
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n/an/a 4.08E+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 (2011)


BindingDB Entry DOI: 10.7270/Q23T9FQ1
More data for this
Ligand-Target Pair