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BDBM42106 1-(3-aminophenyl)-2-(4,6-dimethyl-2-pyrimidinyl)guanidine::1-(3-aminophenyl)-2-(4,6-dimethylpyrimidin-2-yl)guanidine::BIM-0034173.P001::cid_5816499

SMILES: Cc1cc(C)nc(NC(N)=Nc2cccc(N)c2)n1

InChI Key: InChIKey=XGQAWNOUOJVCQF-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 42106   
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
nuclear receptor subfamily 4, group A, member 1


(Homo sapiens (Human))
BDBM42106
PNG
(1-(3-aminophenyl)-2-(4,6-dimethyl-2-pyrimidinyl)gu...)
Show SMILES Cc1cc(C)nc(NC(N)=Nc2cccc(N)c2)n1 |w:10.10|
Show InChI InChI=1S/C13H16N6/c1-8-6-9(2)17-13(16-8)19-12(15)18-11-5-3-4-10(14)7-11/h3-7H,14H2,1-2H3,(H3,15,16,17,18,19)
PDB
MMDB

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Similars

PCBioAssay
n/an/an/an/a 5.45E+3n/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 (2008)


BindingDB Entry DOI: 10.7270/Q2R78CMH
More data for this
Ligand-Target Pair