BDBM225520 GTC000228A::GTC000228B::GTC000228C

SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F

InChI Key InChIKey=ITEPKSLPXLETPN-UHFFFAOYSA-N

Data  15 IC50

Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 225520   

TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 2.45nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 2.86nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 2.07nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 1.38nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 3.35nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 1.47nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 2.08nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 7nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 4.35nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 2.02nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 5.36nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 2nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 3.66nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 2.13nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetSYK Kinase(Homo sapiens (Human))
D3R

LigandPNGBDBM225520(GTC000228A | GTC000228B | GTC000228C)
Show SMILES COCCCN(c1cccc2[nH]ncc12)c1nc(Nc2ccc3CNS(=O)(=O)c3c2)ncc1F
Show InChI InChI=1S/C22H22FN7O3S/c1-33-9-3-8-30(19-5-2-4-18-16(19)12-25-29-18)21-17(23)13-24-22(28-21)27-15-7-6-14-11-26-34(31,32)20(14)10-15/h2,4-7,10,12-13,26H,3,8-9,11H2,1H3,(H,25,29)(H,24,27,28)
Affinity DataIC50: 1.10nMAssay Description:SYK assay_HTRFMore data for this Ligand-Target Pair
Target InfoPDB
GoogleScholar
Ligand InfoPC cidPC sid
In DepthDetails PubMed