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SMILES: Cc1ccc(Cn2cc3c(N)nc(nc3n2)-c2ccsn2)cc1F

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 3 hits for monomerid = 626057   
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 A2a


(Homo sapiens (Human))
BDBM626057
PNG
(US11786528, Example 19)
Show SMILES Cc1ccc(Cn2cc3c(N)nc(nc3n2)-c2ccsn2)cc1F
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 5.60n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Adenosine receptor A1


(Homo sapiens (Human))
BDBM626057
PNG
(US11786528, Example 19)
Show SMILES Cc1ccc(Cn2cc3c(N)nc(nc3n2)-c2ccsn2)cc1F
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 1.18E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Alpha-2B adrenergic receptor


(Homo sapiens (Human))
BDBM626057
PNG
(US11786528, Example 19)
Show SMILES Cc1ccc(Cn2cc3c(N)nc(nc3n2)-c2ccsn2)cc1F
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 1.45E+3n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair