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SMILES: Nc1nc(-c2cccc(C#N)c2F)c2cnn(Cc3ccc(N)c(c3)C(F)(F)F)c2n1

InChI Key:

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 2 hits for monomerid = 633493   
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
Adenosine receptor A1


(Homo sapiens (Human))
BDBM633493
PNG
(3-(6-amino-1-(4-amino-3-(trifluoromethyl)benzyl)-1...)
Show SMILES Nc1nc(-c2cccc(C#N)c2F)c2cnn(Cc3ccc(N)c(c3)C(F)(F)F)c2n1
PDB

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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
<20n/an/an/an/an/an/an/an/a



NERVIANO MEDICAL SCIENCES S.R.L.

US Patent




US Patent US9255087 (2016)


BindingDB Entry DOI: 10.7270/Q20G3J06
More data for this
Ligand-Target Pair
Adenosine receptor A2a


(Homo sapiens (Human))
BDBM633493
PNG
(3-(6-amino-1-(4-amino-3-(trifluoromethyl)benzyl)-1...)
Show SMILES Nc1nc(-c2cccc(C#N)c2F)c2cnn(Cc3ccc(N)c(c3)C(F)(F)F)c2n1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
<100n/an/an/an/an/an/an/an/a



NERVIANO MEDICAL SCIENCES S.R.L.

US Patent




US Patent US9255087 (2016)


BindingDB Entry DOI: 10.7270/Q20G3J06
More data for this
Ligand-Target Pair