BindingDB logo
myBDB logout

BDBM37721 2-(3-chlorophenyl)-4-N-methyltriazole-4,5-diamine::2-(3-chlorophenyl)-N-methyl-2H-1,2,3-triazole-4,5-diamine::2-(3-chlorophenyl)-N4-methyl-1,2,3-triazole-4,5-diamine::2-(3-chlorophenyl)-N4-methyltriazole-4,5-diamine::MLS000091276::SMR000025838::[5-amino-2-(3-chlorophenyl)triazol-4-yl]-methyl-amine::cid_3240793

SMILES: CNc1nn(nc1N)-c1cccc(Cl)c1

InChI Key: InChIKey=UDYXQSKRAZKRDP-UHFFFAOYSA-N

Data: 2 KI  4 IC50  2 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 8 hits for monomerid = 37721   
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
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM37721
PNG
(2-(3-chlorophenyl)-4-N-methyltriazole-4,5-diamine ...)
Show SMILES CNc1nn(nc1N)-c1cccc(Cl)c1
Show InChI InChI=1S/C9H10ClN5/c1-12-9-8(11)13-15(14-9)7-4-2-3-6(10)5-7/h2-5H,1H3,(H2,11,13)(H,12,14)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
1.10E+4n/an/an/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph....


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2DF6PMF
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor


(Homo sapiens (Human))
BDBM37721
PNG
(2-(3-chlorophenyl)-4-N-methyltriazole-4,5-diamine ...)
Show SMILES CNc1nn(nc1N)-c1cccc(Cl)c1
Show InChI InChI=1S/C9H10ClN5/c1-12-9-8(11)13-15(14-9)7-4-2-3-6(10)5-7/h2-5H,1H3,(H2,11,13)(H,12,14)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
>4.37E+4n/an/an/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2NZ862K
More data for this
Ligand-Target Pair
D(1A) dopamine receptor


(Homo sapiens (Human))
BDBM37721
PNG
(2-(3-chlorophenyl)-4-N-methyltriazole-4,5-diamine ...)
Show SMILES CNc1nn(nc1N)-c1cccc(Cl)c1
Show InChI InChI=1S/C9H10ClN5/c1-12-9-8(11)13-15(14-9)7-4-2-3-6(10)5-7/h2-5H,1H3,(H2,11,13)(H,12,14)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 0.325n/an/an/an/a



Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters

Curated by PubChem BioAssay


Assay Description
Assay Provider: Val Watts Assay Provider Affiliation: Purdue University Grant Title: Allosteric Modulators of D1 Receptors Grant Number: 1 X01 MH0776...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2H41PVH
More data for this
Ligand-Target Pair
large T antigen


(Simian virus 40)
BDBM37721
PNG
(2-(3-chlorophenyl)-4-N-methyltriazole-4,5-diamine ...)
Show SMILES CNc1nn(nc1N)-c1cccc(Cl)c1
Show InChI InChI=1S/C9H10ClN5/c1-12-9-8(11)13-15(14-9)7-4-2-3-6(10)5-7/h2-5H,1H3,(H2,11,13)(H,12,14)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 2.99E+4n/an/an/an/an/an/a



Southern Research Specialized Biocontainment Screening Center

Curated by PubChem BioAssay


Assay Description
A biochemical assay using the ADP-Hunter methodology, purified TAg, and ATP to identify compounds that inhibit the ATPase activity of Tag Southern Re...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2M61HQ8
More data for this
Ligand-Target Pair
Group III secretory phopholipase A2


(Homo sapiens (Human))
BDBM37721
PNG
(2-(3-chlorophenyl)-4-N-methyltriazole-4,5-diamine ...)
Show SMILES CNc1nn(nc1N)-c1cccc(Cl)c1
Show InChI InChI=1S/C9H10ClN5/c1-12-9-8(11)13-15(14-9)7-4-2-3-6(10)5-7/h2-5H,1H3,(H2,11,13)(H,12,14)
KEGG

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.22E+5n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Affiliation: The Scripps Research Institute, TSRI Assay Provide...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2CV4GCW
More data for this
Ligand-Target Pair
N-formyl peptide receptor 2


(Homo sapiens (Human))
BDBM37721
PNG
(2-(3-chlorophenyl)-4-N-methyltriazole-4,5-diamine ...)
Show SMILES CNc1nn(nc1N)-c1cccc(Cl)c1
Show InChI InChI=1S/C9H10ClN5/c1-12-9-8(11)13-15(14-9)7-4-2-3-6(10)5-7/h2-5H,1H3,(H2,11,13)(H,12,14)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.82E+4n/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph....


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2DF6PMF
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor


(Homo sapiens (Human))
BDBM37721
PNG
(2-(3-chlorophenyl)-4-N-methyltriazole-4,5-diamine ...)
Show SMILES CNc1nn(nc1N)-c1cccc(Cl)c1
Show InChI InChI=1S/C9H10ClN5/c1-12-9-8(11)13-15(14-9)7-4-2-3-6(10)5-7/h2-5H,1H3,(H2,11,13)(H,12,14)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a>6.67E+4n/an/an/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: NIH 1R03MH076381-01 Assay for Formylpeptide Receptor Family Ligands PI: Bruce S. Edwards, Ph...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2J67FB5
More data for this
Ligand-Target Pair
D(1B) dopamine receptor


(Homo sapiens (Human))
BDBM37721
PNG
(2-(3-chlorophenyl)-4-N-methyltriazole-4,5-diamine ...)
Show SMILES CNc1nn(nc1N)-c1cccc(Cl)c1
Show InChI InChI=1S/C9H10ClN5/c1-12-9-8(11)13-15(14-9)7-4-2-3-6(10)5-7/h2-5H,1H3,(H2,11,13)(H,12,14)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a 0.0151n/an/an/an/a



Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters

Curated by PubChem BioAssay


Assay Description
Assay Provider: Val Watts Assay Provider Affiliation: Purdue University Grant Title: Allosteric Modulators of D1 Receptors Grant Number: 1 X01 MH0776...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2MW2FJG
More data for this
Ligand-Target Pair