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Compile Data Set for Download or QSAR

Found 5 hits of ic50 for monomerid = 50404889   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Stromelysin-3


(Mus musculus)
BDBM50404889
PNG
(CHEMBL303714)
Show SMILES NCc1nc2ccccc2[nH]1
Show InChI InChI=1S/C8H9N3/c9-5-8-10-6-3-1-2-4-7(6)11-8/h1-4H,5,9H2,(H,10,11)
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n/an/a 0.0280n/an/an/an/an/an/a



National Research Centre

Curated by ChEMBL


Assay Description
Cytotoxicity against human NB-1 cells by MTT assay


Bioorg Med Chem Lett 19: 2420-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.069
BindingDB Entry DOI: 10.7270/Q2W098R8
More data for this
Ligand-Target Pair
Reverse transcriptase


(Human immunodeficiency virus 1)
BDBM50404889
PNG
(CHEMBL303714)
Show SMILES NCc1nc2ccccc2[nH]1
Show InChI InChI=1S/C8H9N3/c9-5-8-10-6-3-1-2-4-7(6)11-8/h1-4H,5,9H2,(H,10,11)
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n/an/a 5.10E+3n/an/an/an/an/an/a



National Research Centre

Curated by ChEMBL


Assay Description
Inhibition of recombinant HIV1 reverse transcriptase in cell free Quan-T-RT by scintillation proximity assay


Bioorg Med Chem Lett 19: 2420-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.069
BindingDB Entry DOI: 10.7270/Q2W098R8
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Rattus norvegicus (Rat))
BDBM50404889
PNG
(CHEMBL303714)
Show SMILES NCc1nc2ccccc2[nH]1
Show InChI InChI=1S/C8H9N3/c9-5-8-10-6-3-1-2-4-7(6)11-8/h1-4H,5,9H2,(H,10,11)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Astellas Pharma Inc.

Curated by ChEMBL


Assay Description
Inhibition of rat VAP-1 expressed in CHO cells using [14C]-benzylamine as substrate preincubated for 30 mins prior to substrate addition measured aft...


Bioorg Med Chem 21: 3873-81 (2013)


Article DOI: 10.1016/j.bmc.2013.04.011
BindingDB Entry DOI: 10.7270/Q22B90DG
More data for this
Ligand-Target Pair
Membrane primary amine oxidase


(Homo sapiens (Human))
BDBM50404889
PNG
(CHEMBL303714)
Show SMILES NCc1nc2ccccc2[nH]1
Show InChI InChI=1S/C8H9N3/c9-5-8-10-6-3-1-2-4-7(6)11-8/h1-4H,5,9H2,(H,10,11)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Astellas Pharma Inc.

Curated by ChEMBL


Assay Description
Inhibition of human VAP-1 expressed in CHO cells using [14C]-benzylamine as substrate preincubated for 30 mins prior to substrate addition measured a...


Bioorg Med Chem 21: 3873-81 (2013)


Article DOI: 10.1016/j.bmc.2013.04.011
BindingDB Entry DOI: 10.7270/Q22B90DG
More data for this
Ligand-Target Pair
Cytochrome P450 2B1


(Rattus norvegicus)
BDBM50404889
PNG
(CHEMBL303714)
Show SMILES NCc1nc2ccccc2[nH]1
Show InChI InChI=1S/C8H9N3/c9-5-8-10-6-3-1-2-4-7(6)11-8/h1-4H,5,9H2,(H,10,11)
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n/an/a 4.57E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory potency to aminopyrine N-demethylase activity (P450) in hepatic microsomes from phenobarbitone-induced rats.


J Med Chem 25: 887-92 (1982)


BindingDB Entry DOI: 10.7270/Q2VT1T8J
More data for this
Ligand-Target Pair