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SMILES: CCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3c(C)nn(CCCO)c3c2)ncc1F

InChI Key: InChIKey=OXVVYSMZECGFOP-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 5 hits for monomerid = 225538   
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))
BDBM225538
PNG
(GTC000242A)
Show SMILES CCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3c(C)nn(CCCO)c3c2)ncc1F
Show InChI InChI=1S/C24H25FN8O/c1-3-32(21-7-4-6-20-18(21)13-27-30-20)23-19(25)14-26-24(29-23)28-16-8-9-17-15(2)31-33(10-5-11-34)22(17)12-16/h4,6-9,12-14,34H,3,5,10-11H2,1-2H3,(H,27,30)(H,26,28,29)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
D3R
n/an/a 3.61n/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))
BDBM225538
PNG
(GTC000242A)
Show SMILES CCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3c(C)nn(CCCO)c3c2)ncc1F
Show InChI InChI=1S/C24H25FN8O/c1-3-32(21-7-4-6-20-18(21)13-27-30-20)23-19(25)14-26-24(29-23)28-16-8-9-17-15(2)31-33(10-5-11-34)22(17)12-16/h4,6-9,12-14,34H,3,5,10-11H2,1-2H3,(H,27,30)(H,26,28,29)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
D3R
n/an/a 9.62n/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))
BDBM225538
PNG
(GTC000242A)
Show SMILES CCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3c(C)nn(CCCO)c3c2)ncc1F
Show InChI InChI=1S/C24H25FN8O/c1-3-32(21-7-4-6-20-18(21)13-27-30-20)23-19(25)14-26-24(29-23)28-16-8-9-17-15(2)31-33(10-5-11-34)22(17)12-16/h4,6-9,12-14,34H,3,5,10-11H2,1-2H3,(H,27,30)(H,26,28,29)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
D3R
n/an/a 3.88n/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))
BDBM225538
PNG
(GTC000242A)
Show SMILES CCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3c(C)nn(CCCO)c3c2)ncc1F
Show InChI InChI=1S/C24H25FN8O/c1-3-32(21-7-4-6-20-18(21)13-27-30-20)23-19(25)14-26-24(29-23)28-16-8-9-17-15(2)31-33(10-5-11-34)22(17)12-16/h4,6-9,12-14,34H,3,5,10-11H2,1-2H3,(H,27,30)(H,26,28,29)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
D3R
n/an/a 2.77n/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))
BDBM225538
PNG
(GTC000242A)
Show SMILES CCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3c(C)nn(CCCO)c3c2)ncc1F
Show InChI InChI=1S/C24H25FN8O/c1-3-32(21-7-4-6-20-18(21)13-27-30-20)23-19(25)14-26-24(29-23)28-16-8-9-17-15(2)31-33(10-5-11-34)22(17)12-16/h4,6-9,12-14,34H,3,5,10-11H2,1-2H3,(H,27,30)(H,26,28,29)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
D3R
n/an/a 1.58n/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