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BDBM65711 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-[4-(diethylamino)-6-oxo-1-cyclohexa-2,4-dienylidene]methyl]-5-propan-2-yl-4-triazolecarbohydrazide::1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-[4-(diethylamino)-6-oxocyclohexa-2,4-dien-1-ylidene]methyl]-5-propan-2-yltriazole-4-carbohydrazide::1-(4-aminofurazan-3-yl)-N'-[(E)-[4-(diethylamino)-6-keto-cyclohexa-2,4-dien-1-ylidene]methyl]-5-isopropyl-triazole-4-carbohydrazide::1-(4-azanyl-1,2,5-oxadiazol-3-yl)-N'-[(E)-[4-(diethylamino)-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene]methyl]-5-propan-2-yl-1,2,3-triazole-4-carbohydrazide::MLS001139440::SMR000647146::cid_5801628

SMILES: CCN(CC)c1ccc(C=NNC(=O)c2nnn(-c3nonc3N)c2C(C)C)c(O)c1

InChI Key: InChIKey=YBCYSQRWBTYEHT-UHFFFAOYSA-N

Data: 1 IC50  4 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 5 hits for monomerid = 65711   
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
Intestinal alkaline phosphatase


(Homo sapiens (Human))
BDBM65711
PNG
(1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-[4-(dieth...)
Show SMILES CCN(CC)c1ccc(C=NNC(=O)c2nnn(-c3nonc3N)c2C(C)C)c(O)c1
Show InChI InChI=1S/C19H25N9O3/c1-5-27(6-2)13-8-7-12(14(29)9-13)10-21-23-19(30)15-16(11(3)4)28(26-22-15)18-17(20)24-31-25-18/h7-11,29H,5-6H2,1-4H3,(H2,20,24)(H,23,30)
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n/an/an/an/a 1.05E+4n/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/Q2ST7N9K
More data for this
Ligand-Target Pair
Intestinal alkaline phosphatase


(Homo sapiens (Human))
BDBM65711
PNG
(1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-[4-(dieth...)
Show SMILES CCN(CC)c1ccc(C=NNC(=O)c2nnn(-c3nonc3N)c2C(C)C)c(O)c1
Show InChI InChI=1S/C19H25N9O3/c1-5-27(6-2)13-8-7-12(14(29)9-13)10-21-23-19(30)15-16(11(3)4)28(26-22-15)18-17(20)24-31-25-18/h7-11,29H,5-6H2,1-4H3,(H2,20,24)(H,23,30)
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n/an/an/an/a 2.06E+4n/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/Q2CF9NKD
More data for this
Ligand-Target Pair
Alkaline phosphatase placental-like


(Homo sapiens (Human))
BDBM65711
PNG
(1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-[4-(dieth...)
Show SMILES CCN(CC)c1ccc(C=NNC(=O)c2nnn(-c3nonc3N)c2C(C)C)c(O)c1
Show InChI InChI=1S/C19H25N9O3/c1-5-27(6-2)13-8-7-12(14(29)9-13)10-21-23-19(30)15-16(11(3)4)28(26-22-15)18-17(20)24-31-25-18/h7-11,29H,5-6H2,1-4H3,(H2,20,24)(H,23,30)
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n/an/an/an/a 7.37E+4n/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/Q20Z71R6
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM65711
PNG
(1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-[4-(dieth...)
Show SMILES CCN(CC)c1ccc(C=NNC(=O)c2nnn(-c3nonc3N)c2C(C)C)c(O)c1
Show InChI InChI=1S/C19H25N9O3/c1-5-27(6-2)13-8-7-12(14(29)9-13)10-21-23-19(30)15-16(11(3)4)28(26-22-15)18-17(20)24-31-25-18/h7-11,29H,5-6H2,1-4H3,(H2,20,24)(H,23,30)
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n/an/an/an/a 1.90E+4n/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/Q24Q7SF3
More data for this
Ligand-Target Pair
Alpi


(Rattus norvegicus (Rat))
BDBM65711
PNG
(1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-[4-(dieth...)
Show SMILES CCN(CC)c1ccc(C=NNC(=O)c2nnn(-c3nonc3N)c2C(C)C)c(O)c1
Show InChI InChI=1S/C19H25N9O3/c1-5-27(6-2)13-8-7-12(14(29)9-13)10-21-23-19(30)15-16(11(3)4)28(26-22-15)18-17(20)24-31-25-18/h7-11,29H,5-6H2,1-4H3,(H2,20,24)(H,23,30)
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n/an/a 7.80E+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/Q25Q4TJ1
More data for this
Ligand-Target Pair