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BDBM39590 3-(3-phenyl-10H-pyridazino[4,3-b]quinoxalin-5-yl)-1-propanol::3-(3-phenyl-10H-pyridazino[4,3-b]quinoxalin-5-yl)propan-1-ol::MLS000079256::SMR000037636::cid_6400926

SMILES: OCCCN1c2ccccc2Nc2nnc(cc12)-c1ccccc1

InChI Key: InChIKey=ZNQPBWPWNXLKKI-UHFFFAOYSA-N

Data: 6 IC50  1 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 7 hits for monomerid = 39590   
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))
BDBM39590
PNG
(3-(3-phenyl-10H-pyridazino[4,3-b]quinoxalin-5-yl)-...)
Show SMILES OCCCN1c2ccccc2Nc2nnc(cc12)-c1ccccc1
Show InChI InChI=1S/C19H18N4O/c24-12-6-11-23-17-10-5-4-9-15(17)20-19-18(23)13-16(21-22-19)14-7-2-1-3-8-14/h1-5,7-10,13,24H,6,11-12H2,(H,20,22)
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n/an/a 9.99E+5n/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
Mitogen-activated protein kinase 10


(Homo sapiens (Human))
BDBM39590
PNG
(3-(3-phenyl-10H-pyridazino[4,3-b]quinoxalin-5-yl)-...)
Show SMILES OCCCN1c2ccccc2Nc2nnc(cc12)-c1ccccc1
Show InChI InChI=1S/C19H18N4O/c24-12-6-11-23-17-10-5-4-9-15(17)20-19-18(23)13-16(21-22-19)14-7-2-1-3-8-14/h1-5,7-10,13,24H,6,11-12H2,(H,20,22)
PDB
MMDB

NCI pathway
Reactome pathway
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n/an/a>3.10E+4n/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 Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2KK996K
More data for this
Ligand-Target Pair
Alkaline phosphatase placental-like


(Homo sapiens (Human))
BDBM39590
PNG
(3-(3-phenyl-10H-pyridazino[4,3-b]quinoxalin-5-yl)-...)
Show SMILES OCCCN1c2ccccc2Nc2nnc(cc12)-c1ccccc1
Show InChI InChI=1S/C19H18N4O/c24-12-6-11-23-17-10-5-4-9-15(17)20-19-18(23)13-16(21-22-19)14-7-2-1-3-8-14/h1-5,7-10,13,24H,6,11-12H2,(H,20,22)
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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)


BindingDB Entry DOI: 10.7270/Q2RV0M49
More data for this
Ligand-Target Pair
Alpi


(Rattus norvegicus (Rat))
BDBM39590
PNG
(3-(3-phenyl-10H-pyridazino[4,3-b]quinoxalin-5-yl)-...)
Show SMILES OCCCN1c2ccccc2Nc2nnc(cc12)-c1ccccc1
Show InChI InChI=1S/C19H18N4O/c24-12-6-11-23-17-10-5-4-9-15(17)20-19-18(23)13-16(21-22-19)14-7-2-1-3-8-14/h1-5,7-10,13,24H,6,11-12H2,(H,20,22)
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n/an/a 1.03E+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, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2DB809V
More data for this
Ligand-Target Pair
Alkaline phosphatase placental-like


(Homo sapiens (Human))
BDBM39590
PNG
(3-(3-phenyl-10H-pyridazino[4,3-b]quinoxalin-5-yl)-...)
Show SMILES OCCCN1c2ccccc2Nc2nnc(cc12)-c1ccccc1
Show InChI InChI=1S/C19H18N4O/c24-12-6-11-23-17-10-5-4-9-15(17)20-19-18(23)13-16(21-22-19)14-7-2-1-3-8-14/h1-5,7-10,13,24H,6,11-12H2,(H,20,22)
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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/Q2NS0SCW
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM39590
PNG
(3-(3-phenyl-10H-pyridazino[4,3-b]quinoxalin-5-yl)-...)
Show SMILES OCCCN1c2ccccc2Nc2nnc(cc12)-c1ccccc1
Show InChI InChI=1S/C19H18N4O/c24-12-6-11-23-17-10-5-4-9-15(17)20-19-18(23)13-16(21-22-19)14-7-2-1-3-8-14/h1-5,7-10,13,24H,6,11-12H2,(H,20,22)
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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/Q2H130G1
More data for this
Ligand-Target Pair
Intestinal alkaline phosphatase


(Homo sapiens (Human))
BDBM39590
PNG
(3-(3-phenyl-10H-pyridazino[4,3-b]quinoxalin-5-yl)-...)
Show SMILES OCCCN1c2ccccc2Nc2nnc(cc12)-c1ccccc1
Show InChI InChI=1S/C19H18N4O/c24-12-6-11-23-17-10-5-4-9-15(17)20-19-18(23)13-16(21-22-19)14-7-2-1-3-8-14/h1-5,7-10,13,24H,6,11-12H2,(H,20,22)
PDB
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KEGG

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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, CA...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2X63KDM
More data for this
Ligand-Target Pair