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BDBM76240 MLS002181668::N'-[1,4-dioxo-4-(4-pentoxyphenyl)butyl]-4-pyridinecarbohydrazide::N'-[4-(4-amoxyphenyl)-4-keto-butanoyl]isonicotinohydrazide::N'-[4-oxidanylidene-4-(4-pentoxyphenyl)butanoyl]pyridine-4-carbohydrazide::N'-[4-oxo-4-(4-pentoxyphenyl)butanoyl]pyridine-4-carbohydrazide::SMR001270698::cid_25162239

SMILES: CCCCCOc1ccc(cc1)C(=O)CCC(=O)NNC(=O)c1ccncc1

InChI Key: InChIKey=PZVWZUQONMKRPZ-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 = 76240   
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))
BDBM76240
PNG
(MLS002181668 | N'-[1,4-dioxo-4-(4-pentoxyphenyl)bu...)
Show SMILES CCCCCOc1ccc(cc1)C(=O)CCC(=O)NNC(=O)c1ccncc1
Show InChI InChI=1S/C21H25N3O4/c1-2-3-4-15-28-18-7-5-16(6-8-18)19(25)9-10-20(26)23-24-21(27)17-11-13-22-14-12-17/h5-8,11-14H,2-4,9-10,15H2,1H3,(H,23,26)(H,24,27)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 2.56E+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 (2010)


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


(Rattus norvegicus (Rat))
BDBM76240
PNG
(MLS002181668 | N'-[1,4-dioxo-4-(4-pentoxyphenyl)bu...)
Show SMILES CCCCCOc1ccc(cc1)C(=O)CCC(=O)NNC(=O)c1ccncc1
Show InChI InChI=1S/C21H25N3O4/c1-2-3-4-15-28-18-7-5-16(6-8-18)19(25)9-10-20(26)23-24-21(27)17-11-13-22-14-12-17/h5-8,11-14H,2-4,9-10,15H2,1H3,(H,23,26)(H,24,27)
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.47E+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, tissue-nonspecific isozyme


(Homo sapiens (Human))
BDBM76240
PNG
(MLS002181668 | N'-[1,4-dioxo-4-(4-pentoxyphenyl)bu...)
Show SMILES CCCCCOc1ccc(cc1)C(=O)CCC(=O)NNC(=O)c1ccncc1
Show InChI InChI=1S/C21H25N3O4/c1-2-3-4-15-28-18-7-5-16(6-8-18)19(25)9-10-20(26)23-24-21(27)17-11-13-22-14-12-17/h5-8,11-14H,2-4,9-10,15H2,1H3,(H,23,26)(H,24,27)
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
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PC cid
PC sid
UniChem
PCBioAssay
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
Alkaline phosphatase placental-like


(Homo sapiens (Human))
BDBM76240
PNG
(MLS002181668 | N'-[1,4-dioxo-4-(4-pentoxyphenyl)bu...)
Show SMILES CCCCCOc1ccc(cc1)C(=O)CCC(=O)NNC(=O)c1ccncc1
Show InChI InChI=1S/C21H25N3O4/c1-2-3-4-15-28-18-7-5-16(6-8-18)19(25)9-10-20(26)23-24-21(27)17-11-13-22-14-12-17/h5-8,11-14H,2-4,9-10,15H2,1H3,(H,23,26)(H,24,27)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
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