BindingDB logo
myBDB logout

PubMed code 19349179

Compile data set for download or QSAR
Found 47 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50395539
PNG
(CHEMBL483165)
Show SMILES Cc1cc2c(ccnc2[nH]1)-c1ccc(cc1)S(=O)(=O)NC1CCS(=O)(=O)CC1
Show InChI InChI=1S/C19H21N3O4S2/c1-13-12-18-17(6-9-20-19(18)21-13)14-2-4-16(5-3-14)28(25,26)22-15-7-10-27(23,24)11-8-15/h2-6,9,12,15,22H,7-8,10-11H2,1H3,(H,20,21)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 13n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413883
PNG
(CHEMBL520473)
Show SMILES Cc1cc2c(ccnc2[nH]1)-c1ccc(NS(=O)(=O)CCN)cc1
Show InChI InChI=1S/C16H18N4O2S/c1-11-10-15-14(6-8-18-16(15)19-11)12-2-4-13(5-3-12)20-23(21,22)9-7-17/h2-6,8,10,20H,7,9,17H2,1H3,(H,18,19)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 16n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (Human))
BDBM50413871
PNG
(CHEMBL473080)
Show SMILES NCCNS(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C15H16N4O2S/c16-7-10-19-22(20,21)12-3-1-11(2-4-12)13-5-8-17-15-14(13)6-9-18-15/h1-6,8-9,19H,7,10,16H2,(H,17,18)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 20n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ROCK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413882
PNG
(CHEMBL482747)
Show SMILES Cc1cc2c(ccnc2[nH]1)-c1ccc(cc1)S(=O)(=O)NCCN
Show InChI InChI=1S/C16H18N4O2S/c1-11-10-15-14(6-8-18-16(15)20-11)12-2-4-13(5-3-12)23(21,22)19-9-7-17/h2-6,8,10,19H,7,9,17H2,1H3,(H,18,20)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 20n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50395539
PNG
(CHEMBL483165)
Show SMILES Cc1cc2c(ccnc2[nH]1)-c1ccc(cc1)S(=O)(=O)NC1CCS(=O)(=O)CC1
Show InChI InChI=1S/C19H21N3O4S2/c1-13-12-18-17(6-9-20-19(18)21-13)14-2-4-16(5-3-14)28(25,26)22-15-7-10-27(23,24)11-8-15/h2-6,9,12,15,22H,7-8,10-11H2,1H3,(H,20,21)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 20n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50395528
PNG
(CHEMBL483557)
Show SMILES Cc1cc2c(ccnc2[nH]1)-c1ccc(cc1)S(=O)(=O)NCCO
Show InChI InChI=1S/C16H17N3O3S/c1-11-10-15-14(6-7-17-16(15)19-11)12-2-4-13(5-3-12)23(21,22)18-8-9-20/h2-7,10,18,20H,8-9H2,1H3,(H,17,19)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 20n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413881
PNG
(CHEMBL519965)
Show SMILES NCCNS(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]c(CC(N)=O)cc12
Show InChI InChI=1S/C17H19N5O3S/c18-6-8-21-26(24,25)13-3-1-11(2-4-13)14-5-7-20-17-15(14)9-12(22-17)10-16(19)23/h1-5,7,9,21H,6,8,10,18H2,(H2,19,23)(H,20,22)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 20n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413875
PNG
(CHEMBL482539)
Show SMILES CNCCNS(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C16H18N4O2S/c1-17-10-11-20-23(21,22)13-4-2-12(3-5-13)14-6-8-18-16-15(14)7-9-19-16/h2-9,17,20H,10-11H2,1H3,(H,18,19)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 32n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413877
PNG
(CHEMBL482540)
Show SMILES O=S(=O)(NC1CNC1)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C16H16N4O2S/c21-23(22,20-12-9-17-10-12)13-3-1-11(2-4-13)14-5-7-18-16-15(14)6-8-19-16/h1-8,12,17,20H,9-10H2,(H,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 32n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413877
PNG
(CHEMBL482540)
Show SMILES O=S(=O)(NC1CNC1)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C16H16N4O2S/c21-23(22,20-12-9-17-10-12)13-3-1-11(2-4-13)14-5-7-18-16-15(14)6-8-19-16/h1-8,12,17,20H,9-10H2,(H,18,19)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 40n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413884
PNG
(CHEMBL483166)
Show SMILES CN(C1CCS(=O)(=O)CC1)S(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]c(C)cc12
Show InChI InChI=1S/C20H23N3O4S2/c1-14-13-19-18(7-10-21-20(19)22-14)15-3-5-17(6-4-15)29(26,27)23(2)16-8-11-28(24,25)12-9-16/h3-7,10,13,16H,8-9,11-12H2,1-2H3,(H,21,22)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 40n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50350908
PNG
(CHEMBL520308)
Show SMILES CN(CCO)S(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]c(C)cc12
Show InChI InChI=1S/C17H19N3O3S/c1-12-11-16-15(7-8-18-17(16)19-12)13-3-5-14(6-4-13)24(22,23)20(2)9-10-21/h3-8,11,21H,9-10H2,1-2H3,(H,18,19)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 40n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413871
PNG
(CHEMBL473080)
Show SMILES NCCNS(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C15H16N4O2S/c16-7-10-19-22(20,21)12-3-1-11(2-4-12)13-5-8-17-15-14(13)6-9-18-15/h1-6,8-9,19H,7,10,16H2,(H,17,18)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 40n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413880
PNG
(CHEMBL482746)
Show SMILES O=S(=O)(NC1CCS(=O)(=O)CC1)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C18H19N3O4S2/c22-26(23)11-7-14(8-12-26)21-27(24,25)15-3-1-13(2-4-15)16-5-9-19-18-17(16)6-10-20-18/h1-6,9-10,14,21H,7-8,11-12H2,(H,19,20)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 50n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413885
PNG
(CHEMBL485145)
Show SMILES Cc1cc2c(ccnc2[nH]1)-c1ccc(NS(C)(=O)=O)cc1
Show InChI InChI=1S/C15H15N3O2S/c1-10-9-14-13(7-8-16-15(14)17-10)11-3-5-12(6-4-11)18-21(2,19)20/h3-9,18H,1-2H3,(H,16,17)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 63n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413880
PNG
(CHEMBL482746)
Show SMILES O=S(=O)(NC1CCS(=O)(=O)CC1)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C18H19N3O4S2/c22-26(23)11-7-14(8-12-26)21-27(24,25)15-3-1-13(2-4-15)16-5-9-19-18-17(16)6-10-20-18/h1-6,9-10,14,21H,7-8,11-12H2,(H,19,20)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 79n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413883
PNG
(CHEMBL520473)
Show SMILES Cc1cc2c(ccnc2[nH]1)-c1ccc(NS(=O)(=O)CCN)cc1
Show InChI InChI=1S/C16H18N4O2S/c1-11-10-15-14(6-8-18-16(15)19-11)12-2-4-13(5-3-12)20-23(21,22)9-7-17/h2-6,8,10,20H,7,9,17H2,1H3,(H,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 126n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413882
PNG
(CHEMBL482747)
Show SMILES Cc1cc2c(ccnc2[nH]1)-c1ccc(cc1)S(=O)(=O)NCCN
Show InChI InChI=1S/C16H18N4O2S/c1-11-10-15-14(6-8-18-16(15)20-11)12-2-4-13(5-3-12)23(21,22)19-9-7-17/h2-6,8,10,19H,7,9,17H2,1H3,(H,18,20)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 126n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413872
PNG
(CHEMBL519028)
Show SMILES NS(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C13H11N3O2S/c14-19(17,18)10-3-1-9(2-4-10)11-5-7-15-13-12(11)6-8-16-13/h1-8H,(H,15,16)(H2,14,17,18)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 158n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413878
PNG
(CHEMBL453707)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C14H13N3O2S/c1-20(18,19)17-11-4-2-10(3-5-11)12-6-8-15-14-13(12)7-9-16-14/h2-9,17H,1H3,(H,15,16)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 158n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413881
PNG
(CHEMBL519965)
Show SMILES NCCNS(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]c(CC(N)=O)cc12
Show InChI InChI=1S/C17H19N5O3S/c18-6-8-21-26(24,25)13-3-1-11(2-4-13)14-5-7-20-17-15(14)9-12(22-17)10-16(19)23/h1-5,7,9,21H,6,8,10,18H2,(H2,19,23)(H,20,22)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 158n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413876
PNG
(CHEMBL520954)
Show SMILES CN(C)CCNS(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C17H20N4O2S/c1-21(2)12-11-20-24(22,23)14-5-3-13(4-6-14)15-7-9-18-17-16(15)8-10-19-17/h3-10,20H,11-12H2,1-2H3,(H,18,19)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 200n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413887
PNG
(CHEMBL520655)
Show SMILES O=S(=O)(N1CCCC1)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C17H17N3O2S/c21-23(22,20-11-1-2-12-20)14-5-3-13(4-6-14)15-7-9-18-17-16(15)8-10-19-17/h3-10H,1-2,11-12H2,(H,18,19)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 251n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413871
PNG
(CHEMBL473080)
Show SMILES NCCNS(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C15H16N4O2S/c16-7-10-19-22(20,21)12-3-1-11(2-4-12)13-5-8-17-15-14(13)6-9-18-15/h1-6,8-9,19H,7,10,16H2,(H,17,18)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 251n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (Human))
BDBM50413882
PNG
(CHEMBL482747)
Show SMILES Cc1cc2c(ccnc2[nH]1)-c1ccc(cc1)S(=O)(=O)NCCN
Show InChI InChI=1S/C16H18N4O2S/c1-11-10-15-14(6-8-18-16(15)20-11)12-2-4-13(5-3-12)23(21,22)19-9-7-17/h2-6,8,10,19H,7,9,17H2,1H3,(H,18,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 316n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ROCK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413886
PNG
(CHEMBL484966)
Show SMILES CN(c1ccc(cc1)-c1ccnc2[nH]c(C)cc12)S(C)(=O)=O
Show InChI InChI=1S/C16H17N3O2S/c1-11-10-15-14(8-9-17-16(15)18-11)12-4-6-13(7-5-12)19(2)22(3,20)21/h4-10H,1-3H3,(H,17,18)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 316n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50395528
PNG
(CHEMBL483557)
Show SMILES Cc1cc2c(ccnc2[nH]1)-c1ccc(cc1)S(=O)(=O)NCCO
Show InChI InChI=1S/C16H17N3O3S/c1-11-10-15-14(6-7-17-16(15)19-11)12-2-4-13(5-3-12)23(21,22)18-8-9-20/h2-7,10,18,20H,8-9H2,1H3,(H,17,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 316n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413872
PNG
(CHEMBL519028)
Show SMILES NS(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C13H11N3O2S/c14-19(17,18)10-3-1-9(2-4-10)11-5-7-15-13-12(11)6-8-16-13/h1-8H,(H,15,16)(H2,14,17,18)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 316n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413875
PNG
(CHEMBL482539)
Show SMILES CNCCNS(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C16H18N4O2S/c1-17-10-11-20-23(21,22)13-4-2-12(3-5-13)14-6-8-18-16-15(14)7-9-19-16/h2-9,17,20H,10-11H2,1H3,(H,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 316n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413873
PNG
(CHEMBL504261)
Show SMILES NC(=O)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C14H11N3O/c15-13(18)10-3-1-9(2-4-10)11-5-7-16-14-12(11)6-8-17-14/h1-8H,(H2,15,18)(H,16,17)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 398n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413873
PNG
(CHEMBL504261)
Show SMILES NC(=O)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C14H11N3O/c15-13(18)10-3-1-9(2-4-10)11-5-7-16-14-12(11)6-8-17-14/h1-8H,(H2,15,18)(H,16,17)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 631n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413878
PNG
(CHEMBL453707)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C14H13N3O2S/c1-20(18,19)17-11-4-2-10(3-5-11)12-6-8-15-14-13(12)7-9-16-14/h2-9,17H,1H3,(H,15,16)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 794n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413876
PNG
(CHEMBL520954)
Show SMILES CN(C)CCNS(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C17H20N4O2S/c1-21(2)12-11-20-24(22,23)14-5-3-13(4-6-14)15-7-9-18-17-16(15)8-10-19-17/h3-10,20H,11-12H2,1-2H3,(H,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 794n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413884
PNG
(CHEMBL483166)
Show SMILES CN(C1CCS(=O)(=O)CC1)S(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]c(C)cc12
Show InChI InChI=1S/C20H23N3O4S2/c1-14-13-19-18(7-10-21-20(19)22-14)15-3-5-17(6-4-15)29(26,27)23(2)16-8-11-28(24,25)12-9-16/h3-7,10,13,16H,8-9,11-12H2,1-2H3,(H,21,22)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413879
PNG
(CHEMBL482553)
Show SMILES NS(=O)(=O)c1cccc(c1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C13H11N3O2S/c14-19(17,18)10-3-1-2-9(8-10)11-4-6-15-13-12(11)5-7-16-13/h1-8H,(H,15,16)(H2,14,17,18)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.26E+3n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413887
PNG
(CHEMBL520655)
Show SMILES O=S(=O)(N1CCCC1)c1ccc(cc1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C17H17N3O2S/c21-23(22,20-11-1-2-12-20)14-5-3-13(4-6-14)15-7-9-18-17-16(15)8-10-19-17/h3-10H,1-2,11-12H2,(H,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.26E+3n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Aurora kinase B


(Homo sapiens (Human))
BDBM50350908
PNG
(CHEMBL520308)
Show SMILES CN(CCO)S(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]c(C)cc12
Show InChI InChI=1S/C17H19N3O3S/c1-12-11-16-15(7-8-18-17(16)19-12)13-3-5-14(6-4-13)24(22,23)20(2)9-10-21/h3-8,11,21H,9-10H2,1-2H3,(H,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 1.59E+3n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of Aurora B kinase


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413874
PNG
(CHEMBL482538)
Show SMILES c1cc2c(ccnc2[nH]1)-c1ccccc1
Show InChI InChI=1S/C13H10N2/c1-2-4-10(5-3-1)11-6-8-14-13-12(11)7-9-15-13/h1-9H,(H,14,15)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.16E+3n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50350908
PNG
(CHEMBL520308)
Show SMILES CN(CCO)S(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]c(C)cc12
Show InChI InChI=1S/C17H19N3O3S/c1-12-11-16-15(7-8-18-17(16)19-12)13-3-5-14(6-4-13)24(22,23)20(2)9-10-21/h3-8,11,21H,9-10H2,1-2H3,(H,18,19)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 3.16E+3n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413874
PNG
(CHEMBL482538)
Show SMILES c1cc2c(ccnc2[nH]1)-c1ccccc1
Show InChI InChI=1S/C13H10N2/c1-2-4-10(5-3-1)11-6-8-14-13-12(11)7-9-15-13/h1-9H,(H,14,15)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.98E+3n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413885
PNG
(CHEMBL485145)
Show SMILES Cc1cc2c(ccnc2[nH]1)-c1ccc(NS(C)(=O)=O)cc1
Show InChI InChI=1S/C15H15N3O2S/c1-10-9-14-13(7-8-16-15(14)17-10)11-3-5-12(6-4-11)18-21(2,19)20/h3-9,18H,1-2H3,(H,16,17)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.98E+3n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413879
PNG
(CHEMBL482553)
Show SMILES NS(=O)(=O)c1cccc(c1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C13H11N3O2S/c14-19(17,18)10-3-1-2-9(8-10)11-4-6-15-13-12(11)5-7-16-13/h1-8H,(H,15,16)(H2,14,17,18)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.01E+3n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK2


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Aurora kinase A-interacting protein


(Homo sapiens (Human))
BDBM50350908
PNG
(CHEMBL520308)
Show SMILES CN(CCO)S(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]c(C)cc12
Show InChI InChI=1S/C17H19N3O3S/c1-12-11-16-15(7-8-18-17(16)19-12)13-3-5-14(6-4-13)24(22,23)20(2)9-10-21/h3-8,11,21H,9-10H2,1-2H3,(H,18,19)
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 7.94E+3n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of Aurora A kinase


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Inhibitor of NF-kappa-B kinase (IKK)


(Homo sapiens (Human))
BDBM50413886
PNG
(CHEMBL484966)
Show SMILES CN(c1ccc(cc1)-c1ccnc2[nH]c(C)cc12)S(C)(=O)=O
Show InChI InChI=1S/C16H17N3O2S/c1-11-10-15-14(8-9-17-16(15)18-11)12-4-6-13(7-5-12)19(2)22(3,20)21/h4-10H,1-3H3,(H,17,18)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.94E+3n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant IKK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (Human))
BDBM50350908
PNG
(CHEMBL520308)
Show SMILES CN(CCO)S(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]c(C)cc12
Show InChI InChI=1S/C17H19N3O3S/c1-12-11-16-15(7-8-18-17(16)19-12)13-3-5-14(6-4-13)24(22,23)20(2)9-10-21/h3-8,11,21H,9-10H2,1-2H3,(H,18,19)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a<1.00E+4n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ROCK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Rho-associated protein kinase 1


(Homo sapiens (Human))
BDBM50413881
PNG
(CHEMBL519965)
Show SMILES NCCNS(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]c(CC(N)=O)cc12
Show InChI InChI=1S/C17H19N5O3S/c18-6-8-21-26(24,25)13-3-1-11(2-4-13)14-5-7-20-17-15(14)9-12(22-17)10-16(19)23/h1-5,7,9,21H,6,8,10,18H2,(H2,19,23)(H,20,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ROCK1


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
Glycogen synthase kinase-3 beta


(Homo sapiens (Human))
BDBM50350908
PNG
(CHEMBL520308)
Show SMILES CN(CCO)S(=O)(=O)c1ccc(cc1)-c1ccnc2[nH]c(C)cc12
Show InChI InChI=1S/C17H19N3O3S/c1-12-11-16-15(7-8-18-17(16)19-12)13-3-5-14(6-4-13)24(22,23)20(2)9-10-21/h3-8,11,21H,9-10H2,1-2H3,(H,18,19)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a<2.51E+4n/an/an/an/an/an/a



GlaxoSmithKline R&D

Curated by ChEMBL


Assay Description
Inhibition of GSK3-beta kinase


Bioorg Med Chem Lett 19: 2504-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.034
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%