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BDBM64780 4-Methyl-benzoic acid N'-(2,6-di-pyrrolidin-1-yl-pyrimidin-4-yl)-hydrazide::MLS000551080::N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-4-methyl-benzohydrazide::N'-(2,6-dipyrrolidin-1-ylpyrimidin-4-yl)-4-methylbenzohydrazide::N'-(2,6-dipyrrolidinopyrimidin-4-yl)-4-methyl-benzohydrazide::N'-[2,6-bis(1-pyrrolidinyl)-4-pyrimidinyl]-4-methylbenzohydrazide::SMR000176238::cid_1109408

SMILES: Cc1ccc(cc1)C(=O)NNc1cc(nc(n1)N1CCCC1)N1CCCC1

InChI Key: InChIKey=AVHYTXJNAXLTFO-UHFFFAOYSA-N

Data: 9 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 9 hits for monomerid = 64780   
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
protein phosphatase 1, catalytic subunit, alpha isoform 3


(Homo sapiens (Human))
BDBM64780
PNG
(4-Methyl-benzoic acid N'-(2,6-di-pyrrolidin-1-...)
Show SMILES Cc1ccc(cc1)C(=O)NNc1cc(nc(n1)N1CCCC1)N1CCCC1
Show InChI InChI=1S/C20H26N6O/c1-15-6-8-16(9-7-15)19(27)24-23-17-14-18(25-10-2-3-11-25)22-20(21-17)26-12-4-5-13-26/h6-9,14H,2-5,10-13H2,1H3,(H,24,27)(H,21,22,23)
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n/an/a 6.40E+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) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q27M06CD
More data for this
Ligand-Target Pair
PPP5C protein


(Homo sapiens (Human))
BDBM64780
PNG
(4-Methyl-benzoic acid N'-(2,6-di-pyrrolidin-1-...)
Show SMILES Cc1ccc(cc1)C(=O)NNc1cc(nc(n1)N1CCCC1)N1CCCC1
Show InChI InChI=1S/C20H26N6O/c1-15-6-8-16(9-7-15)19(27)24-23-17-14-18(25-10-2-3-11-25)22-20(21-17)26-12-4-5-13-26/h6-9,14H,2-5,10-13H2,1H3,(H,24,27)(H,21,22,23)
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n/an/a 4.10E+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) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q23T9FN4
More data for this
Ligand-Target Pair
SUMO/sentrin specific peptidase family member 8


(Homo sapiens (Human))
BDBM64780
PNG
(4-Methyl-benzoic acid N'-(2,6-di-pyrrolidin-1-...)
Show SMILES Cc1ccc(cc1)C(=O)NNc1cc(nc(n1)N1CCCC1)N1CCCC1
Show InChI InChI=1S/C20H26N6O/c1-15-6-8-16(9-7-15)19(27)24-23-17-14-18(25-10-2-3-11-25)22-20(21-17)26-12-4-5-13-26/h6-9,14H,2-5,10-13H2,1H3,(H,24,27)(H,21,22,23)
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n/an/a 4.60E+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 (2010)


BindingDB Entry DOI: 10.7270/Q2MS3R7H
More data for this
Ligand-Target Pair
SUMO/sentrin specific peptidase family member 8


(Homo sapiens (Human))
BDBM64780
PNG
(4-Methyl-benzoic acid N'-(2,6-di-pyrrolidin-1-...)
Show SMILES Cc1ccc(cc1)C(=O)NNc1cc(nc(n1)N1CCCC1)N1CCCC1
Show InChI InChI=1S/C20H26N6O/c1-15-6-8-16(9-7-15)19(27)24-23-17-14-18(25-10-2-3-11-25)22-20(21-17)26-12-4-5-13-26/h6-9,14H,2-5,10-13H2,1H3,(H,24,27)(H,21,22,23)
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n/an/a>5.00E+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/Q2C827R9
More data for this
Ligand-Target Pair
Caspase-9


(Homo sapiens (Human))
BDBM64780
PNG
(4-Methyl-benzoic acid N'-(2,6-di-pyrrolidin-1-...)
Show SMILES Cc1ccc(cc1)C(=O)NNc1cc(nc(n1)N1CCCC1)N1CCCC1
Show InChI InChI=1S/C20H26N6O/c1-15-6-8-16(9-7-15)19(27)24-23-17-14-18(25-10-2-3-11-25)22-20(21-17)26-12-4-5-13-26/h6-9,14H,2-5,10-13H2,1H3,(H,24,27)(H,21,22,23)
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n/an/a 2.74E+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 (SBIMR, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q25M647F
More data for this
Ligand-Target Pair
Caspase-3


(Homo sapiens (Human))
BDBM64780
PNG
(4-Methyl-benzoic acid N'-(2,6-di-pyrrolidin-1-...)
Show SMILES Cc1ccc(cc1)C(=O)NNc1cc(nc(n1)N1CCCC1)N1CCCC1
Show InChI InChI=1S/C20H26N6O/c1-15-6-8-16(9-7-15)19(27)24-23-17-14-18(25-10-2-3-11-25)22-20(21-17)26-12-4-5-13-26/h6-9,14H,2-5,10-13H2,1H3,(H,24,27)(H,21,22,23)
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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/Q2RJ4GZT
More data for this
Ligand-Target Pair
Apoptotic peptidase activating factor 1


(Homo sapiens (Human))
BDBM64780
PNG
(4-Methyl-benzoic acid N'-(2,6-di-pyrrolidin-1-...)
Show SMILES Cc1ccc(cc1)C(=O)NNc1cc(nc(n1)N1CCCC1)N1CCCC1
Show InChI InChI=1S/C20H26N6O/c1-15-6-8-16(9-7-15)19(27)24-23-17-14-18(25-10-2-3-11-25)22-20(21-17)26-12-4-5-13-26/h6-9,14H,2-5,10-13H2,1H3,(H,24,27)(H,21,22,23)
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n/an/a 5.08E+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 (SBIMR, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2JS9NZB
More data for this
Ligand-Target Pair
Apoptotic peptidase activating factor 1


(Homo sapiens (Human))
BDBM64780
PNG
(4-Methyl-benzoic acid N'-(2,6-di-pyrrolidin-1-...)
Show SMILES Cc1ccc(cc1)C(=O)NNc1cc(nc(n1)N1CCCC1)N1CCCC1
Show InChI InChI=1S/C20H26N6O/c1-15-6-8-16(9-7-15)19(27)24-23-17-14-18(25-10-2-3-11-25)22-20(21-17)26-12-4-5-13-26/h6-9,14H,2-5,10-13H2,1H3,(H,24,27)(H,21,22,23)
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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 (SBIMR, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2F18X8S
More data for this
Ligand-Target Pair
SUMO-1-specific protease


(Homo sapiens (Human))
BDBM64780
PNG
(4-Methyl-benzoic acid N'-(2,6-di-pyrrolidin-1-...)
Show SMILES Cc1ccc(cc1)C(=O)NNc1cc(nc(n1)N1CCCC1)N1CCCC1
Show InChI InChI=1S/C20H26N6O/c1-15-6-8-16(9-7-15)19(27)24-23-17-14-18(25-10-2-3-11-25)22-20(21-17)26-12-4-5-13-26/h6-9,14H,2-5,10-13H2,1H3,(H,24,27)(H,21,22,23)
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n/an/a 838n/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/Q27H1H10
More data for this
Ligand-Target Pair