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SMILES: NCCCN(c1ccnc(Nc2ccc3CNS(=O)(=O)c3c2)n1)c1cccc2[nH]ncc12

InChI Key: InChIKey=DEOIVYWPILSMOB-UHFFFAOYSA-N

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 = 225519   
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
Tyrosine-protein kinase SYK [355-635]


(Homo sapiens (Human))
BDBM225519
PNG
(GTC000227A)
Show SMILES NCCCN(c1ccnc(Nc2ccc3CNS(=O)(=O)c3c2)n1)c1cccc2[nH]ncc12
Show InChI InChI=1S/C21H22N8O2S/c22-8-2-10-29(18-4-1-3-17-16(18)13-24-28-17)20-7-9-23-21(27-20)26-15-6-5-14-12-25-32(30,31)19(14)11-15/h1,3-7,9,11,13,25H,2,8,10,12,22H2,(H,24,28)(H,23,26,27)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
D3R
n/an/a 0.857n/an/an/an/an/an/a



D3R



Assay Description
SYK assay_HTRF


D3R 225: (2015)


BindingDB Entry DOI: 10.7270/Q2CV4GM1
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK [355-635]


(Homo sapiens (Human))
BDBM225519
PNG
(GTC000227A)
Show SMILES NCCCN(c1ccnc(Nc2ccc3CNS(=O)(=O)c3c2)n1)c1cccc2[nH]ncc12
Show InChI InChI=1S/C21H22N8O2S/c22-8-2-10-29(18-4-1-3-17-16(18)13-24-28-17)20-7-9-23-21(27-20)26-15-6-5-14-12-25-32(30,31)19(14)11-15/h1,3-7,9,11,13,25H,2,8,10,12,22H2,(H,24,28)(H,23,26,27)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
D3R
n/an/a 3.63n/an/an/an/an/an/a



D3R



Assay Description
SYK assay_HTRF


D3R 225: (2015)


BindingDB Entry DOI: 10.7270/Q2CV4GM1
More data for this
Ligand-Target Pair
Tyrosine-protein kinase SYK [355-635]


(Homo sapiens (Human))
BDBM225519
PNG
(GTC000227A)
Show SMILES NCCCN(c1ccnc(Nc2ccc3CNS(=O)(=O)c3c2)n1)c1cccc2[nH]ncc12
Show InChI InChI=1S/C21H22N8O2S/c22-8-2-10-29(18-4-1-3-17-16(18)13-24-28-17)20-7-9-23-21(27-20)26-15-6-5-14-12-25-32(30,31)19(14)11-15/h1,3-7,9,11,13,25H,2,8,10,12,22H2,(H,24,28)(H,23,26,27)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
D3R
n/an/a 0.75n/an/an/an/an/an/a



D3R



Assay Description
SYK assay_HTRF


D3R 225: (2015)


BindingDB Entry DOI: 10.7270/Q2CV4GM1
More data for this
Ligand-Target Pair