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BDBM39050 1-(4-methoxyphenyl)-4-(1-piperidinyl)pyrazolo[3,4-d]pyrimidine::1-(4-methoxyphenyl)-4-piperidin-1-yl-pyrazolo[3,4-d]pyrimidine::1-(4-methoxyphenyl)-4-piperidin-1-ylpyrazolo[3,4-d]pyrimidine::1-(4-methoxyphenyl)-4-piperidino-pyrazolo[3,4-d]pyrimidine::MLS000100820::SMR000017483::cid_866503

SMILES: COc1ccc(cc1)-n1ncc2c(ncnc12)N1CCCCC1

InChI Key: InChIKey=HDIRSVJGBJGHFV-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 39050   
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
Steroidogenic Factor 1


(Homo sapiens (Human))
BDBM39050
PNG
(1-(4-methoxyphenyl)-4-(1-piperidinyl)pyrazolo[3,4-...)
Show SMILES COc1ccc(cc1)-n1ncc2c(ncnc12)N1CCCCC1
Show InChI InChI=1S/C17H19N5O/c1-23-14-7-5-13(6-8-14)22-17-15(11-20-22)16(18-12-19-17)21-9-3-2-4-10-21/h5-8,11-12H,2-4,9-10H2,1H3
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MMDB

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PC sid
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PCBioAssay
n/an/a 1.77E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


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


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2319T8T
More data for this
Ligand-Target Pair
Nuclear receptor ROR-alpha


(Homo sapiens (Human))
BDBM39050
PNG
(1-(4-methoxyphenyl)-4-(1-piperidinyl)pyrazolo[3,4-...)
Show SMILES COc1ccc(cc1)-n1ncc2c(ncnc12)N1CCCCC1
Show InChI InChI=1S/C17H19N5O/c1-23-14-7-5-13(6-8-14)22-17-15(11-20-22)16(18-12-19-17)21-9-3-2-4-10-21/h5-8,11-12H,2-4,9-10H2,1H3
PDB
MMDB

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PCBioAssay
n/an/a 1.60E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


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


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q26Q1VNZ
More data for this
Ligand-Target Pair
Steroidogenic Factor 1


(Homo sapiens (Human))
BDBM39050
PNG
(1-(4-methoxyphenyl)-4-(1-piperidinyl)pyrazolo[3,4-...)
Show SMILES COc1ccc(cc1)-n1ncc2c(ncnc12)N1CCCCC1
Show InChI InChI=1S/C17H19N5O/c1-23-14-7-5-13(6-8-14)22-17-15(11-20-22)16(18-12-19-17)21-9-3-2-4-10-21/h5-8,11-12H,2-4,9-10H2,1H3
PDB
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UniChem

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PCBioAssay
n/an/a 2.00E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


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


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2PR7TCX
More data for this
Ligand-Target Pair
Nuclear receptor ROR-alpha


(Homo sapiens (Human))
BDBM39050
PNG
(1-(4-methoxyphenyl)-4-(1-piperidinyl)pyrazolo[3,4-...)
Show SMILES COc1ccc(cc1)-n1ncc2c(ncnc12)N1CCCCC1
Show InChI InChI=1S/C17H19N5O/c1-23-14-7-5-13(6-8-14)22-17-15(11-20-22)16(18-12-19-17)21-9-3-2-4-10-21/h5-8,11-12H,2-4,9-10H2,1H3
PDB
MMDB

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PCBioAssay
n/an/a 1.39E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


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


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2TH8K3N
More data for this
Ligand-Target Pair