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3 similar compounds to monomer 29625

Compile data set for download or QSAR
Wt: 216.2
BDBM43789
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Wt: 328.3
BDBM51320
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Wt: 234.2
BDBM56835
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 43789,51320,56835   
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, tissue-nonspecific isozyme


(Homo sapiens)
BDBM43789
PNG
(3-phenyl-N-(1H-1,2,4-triazol-5-yl)propanamide | 3-...)
Show SMILES O=C(CCc1ccccc1)Nc1nnc[nH]1
Show InChI InChI=1S/C11H12N4O/c16-10(14-11-12-8-13-15-11)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H2,12,13,14,15,16)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

PCBioAssay
n/an/an/an/a 1.82E+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/Q20K26Z8
More data for this
Ligand-Target Pair
Alkaline phosphatase placental-like


(Homo sapiens)
BDBM43789
PNG
(3-phenyl-N-(1H-1,2,4-triazol-5-yl)propanamide | 3-...)
Show SMILES O=C(CCc1ccccc1)Nc1nnc[nH]1
Show InChI InChI=1S/C11H12N4O/c16-10(14-11-12-8-13-15-11)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H2,12,13,14,15,16)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

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 (2009)


BindingDB Entry DOI: 10.7270/Q29S1PG8
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM43789
PNG
(3-phenyl-N-(1H-1,2,4-triazol-5-yl)propanamide | 3-...)
Show SMILES O=C(CCc1ccccc1)Nc1nnc[nH]1
Show InChI InChI=1S/C11H12N4O/c16-10(14-11-12-8-13-15-11)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H2,12,13,14,15,16)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

PCBioAssay
n/an/an/an/a 3.25E+4n/an/an/an/a



Sanford-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 (2009)


BindingDB Entry DOI: 10.7270/Q2N58JTN
More data for this
Ligand-Target Pair
Alkaline phosphatase, tissue-nonspecific isozyme


(Homo sapiens)
BDBM43789
PNG
(3-phenyl-N-(1H-1,2,4-triazol-5-yl)propanamide | 3-...)
Show SMILES O=C(CCc1ccccc1)Nc1nnc[nH]1
Show InChI InChI=1S/C11H12N4O/c16-10(14-11-12-8-13-15-11)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H2,12,13,14,15,16)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

PCBioAssay
n/an/an/an/a 1.18E+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 (2009)


BindingDB Entry DOI: 10.7270/Q26Q1VPD
More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens)
BDBM56835
PNG
(2-amino-5-phenyl-4-thiazolecarboxylic acid methyl ...)
Show SMILES COC(=O)c1nc(N)sc1-c1ccccc1
Show InChI InChI=1S/C11H10N2O2S/c1-15-10(14)8-9(16-11(12)13-8)7-5-3-2-4-6-7/h2-6H,1H3,(H2,12,13)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Patents


Similars

PCBioAssay
n/an/a 4.25E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Project Title: A screen for modulators of human Rad51, a key DNA repair protein Application Number: MH084119 Assay Submitter: Dr. Alex Mazin Submitte...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2BV7F1T
More data for this
Ligand-Target Pair
DNA repair protein RAD51 homolog 1


(Homo sapiens)
BDBM51320
PNG
(4-[2-(4-methylphenyl)-3,4-dioxo-1-cyclobutenyl]-1-...)
Show SMILES CCOC(=O)N1CCN(CC1)c1c(-c2ccc(C)cc2)c(=O)c1=O
Show InChI InChI=1S/C18H20N2O4/c1-3-24-18(23)20-10-8-19(9-11-20)15-14(16(21)17(15)22)13-6-4-12(2)5-7-13/h4-7H,3,8-11H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 5.30E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Project Title: A screen for modulators of human Rad51, a key DNA repair protein Application Number: MH084119 Assay Submitter: Dr. Alex Mazin Submitte...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2QN6558
More data for this
Ligand-Target Pair