BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 112 hits from Beijing Pearl Biotech Ltd   
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
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159537
PNG
(CHEMBL3785722)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCN(C)CC2)ncc1C
Show InChI InChI=1S/C28H39N7O3S/c1-17(2)39(36,37)27-24(16-35(6)33-27)30-26-19(4)15-29-28(32-26)31-23-13-18(3)22(14-25(23)38-21-7-8-21)20-9-11-34(5)12-10-20/h13-17,20-21H,7-12H2,1-6H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113626
PNG
(CHEMBL3604634)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCN(C)CC2)ncc1Cl
Show InChI InChI=1S/C27H36ClN7O3S/c1-16(2)39(36,37)26-23(15-35(5)33-26)30-25-21(28)14-29-27(32-25)31-22-12-17(3)20(13-24(22)38-19-6-7-19)18-8-10-34(4)11-9-18/h12-16,18-19H,6-11H2,1-5H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 1n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113508
PNG
(CHEMBL3604649)
Show SMILES CC(C)N1CCC(CC1)c1cc(OC2CC2)c(Nc2ncc(Cl)c(Nc3cn(C)nc3S(=O)(=O)C(C)C)n2)cc1C
Show InChI InChI=1S/C29H40ClN7O3S/c1-17(2)37-11-9-20(10-12-37)22-14-26(40-21-7-8-21)24(13-19(22)5)33-29-31-15-23(30)27(34-29)32-25-16-36(6)35-28(25)41(38,39)18(3)4/h13-18,20-21H,7-12H2,1-6H3,(H2,31,32,33,34)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113514
PNG
(CHEMBL3604652)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(CCN(C)C)cc2OC2CC2)ncc1Cl
Show InChI InChI=1S/C25H34ClN7O3S/c1-15(2)37(34,35)24-21(14-33(6)31-24)28-23-19(26)13-27-25(30-23)29-20-11-16(3)17(9-10-32(4)5)12-22(20)36-18-7-8-18/h11-15,18H,7-10H2,1-6H3,(H2,27,28,29,30)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113627
PNG
(CHEMBL3604633)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCNCC2)ncc1Cl
Show InChI InChI=1S/C26H34ClN7O3S/c1-15(2)38(35,36)25-22(14-34(4)33-25)30-24-20(27)13-29-26(32-24)31-21-11-16(3)19(17-7-9-28-10-8-17)12-23(21)37-18-5-6-18/h11-15,17-18,28H,5-10H2,1-4H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113626
PNG
(CHEMBL3604634)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCN(C)CC2)ncc1Cl
Show InChI InChI=1S/C27H36ClN7O3S/c1-16(2)39(36,37)26-23(15-35(5)33-26)30-25-21(28)14-29-27(32-25)31-22-12-17(3)20(13-24(22)38-19-6-7-19)18-8-10-34(4)11-9-18/h12-16,18-19H,6-11H2,1-5H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113518
PNG
(CHEMBL3604646)
Show SMILES CC(C)Oc1cc(C2CN(C)C2)c(C)cc1Nc1ncc(Cl)c(Nc2cn(C)nc2S(=O)(=O)C(C)C)n1
Show InChI InChI=1S/C25H34ClN7O3S/c1-14(2)36-22-9-18(17-11-32(6)12-17)16(5)8-20(22)29-25-27-10-19(26)23(30-25)28-21-13-33(7)31-24(21)37(34,35)15(3)4/h8-10,13-15,17H,11-12H2,1-7H3,(H2,27,28,29,30)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159539
PNG
(CHEMBL3787598)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCN(C)CC2)ncc1F
Show InChI InChI=1S/C27H36FN7O3S/c1-16(2)39(36,37)26-23(15-35(5)33-26)30-25-21(28)14-29-27(32-25)31-22-12-17(3)20(13-24(22)38-19-6-7-19)18-8-10-34(4)11-9-18/h12-16,18-19H,6-11H2,1-5H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159541
PNG
(CHEMBL3785890)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCN(C)CC2)ncc1C#N
Show InChI InChI=1S/C28H36N8O3S/c1-17(2)40(37,38)27-24(16-36(5)34-27)31-26-20(14-29)15-30-28(33-26)32-23-12-18(3)22(13-25(23)39-21-6-7-21)19-8-10-35(4)11-9-19/h12-13,15-17,19,21H,6-11H2,1-5H3,(H2,30,31,32,33)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113510
PNG
(CHEMBL3604656)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCCN(C)C2)ncc1Cl
Show InChI InChI=1S/C27H36ClN7O3S/c1-16(2)39(36,37)26-23(15-35(5)33-26)30-25-21(28)13-29-27(32-25)31-22-11-17(3)20(12-24(22)38-19-8-9-19)18-7-6-10-34(4)14-18/h11-13,15-16,18-19H,6-10,14H2,1-5H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 3n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113523
PNG
(CHEMBL3604641)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2ccc(cc2OC2CC2)C2CCN(C)CC2)ncc1Cl
Show InChI InChI=1S/C26H34ClN7O3S/c1-16(2)38(35,36)25-22(15-34(4)32-25)29-24-20(27)14-28-26(31-24)30-21-8-5-18(13-23(21)37-19-6-7-19)17-9-11-33(3)12-10-17/h5,8,13-17,19H,6-7,9-12H2,1-4H3,(H2,28,29,30,31)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 3n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113522
PNG
(CHEMBL3604642)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(F)c(cc2OC2CC2)C2CCN(C)CC2)ncc1Cl
Show InChI InChI=1S/C26H33ClFN7O3S/c1-15(2)39(36,37)25-22(14-35(4)33-25)30-24-19(27)13-29-26(32-24)31-21-12-20(28)18(11-23(21)38-17-5-6-17)16-7-9-34(3)10-8-16/h11-17H,5-10H2,1-4H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 3n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159514
PNG
(CHEMBL3785607)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCS(=O)(=O)CC2)ncc1Cl
Show InChI InChI=1S/C26H33ClN6O5S2/c1-15(2)40(36,37)25-22(14-33(4)32-25)29-24-20(27)13-28-26(31-24)30-21-11-16(3)19(12-23(21)38-18-5-6-18)17-7-9-39(34,35)10-8-17/h11-15,17-18H,5-10H2,1-4H3,(H2,28,29,30,31)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159522
PNG
(CHEMBL3785711)
Show SMILES CC(C)CS(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC(C)C)C2CCNCC2)ncc1Cl
Show InChI InChI=1S/C27H38ClN7O3S/c1-16(2)15-39(36,37)26-23(14-35(6)34-26)31-25-21(28)13-30-27(33-25)32-22-11-18(5)20(12-24(22)38-17(3)4)19-7-9-29-10-8-19/h11-14,16-17,19,29H,7-10,15H2,1-6H3,(H2,30,31,32,33)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 3n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159531
PNG
(CHEMBL3786148)
Show SMILES CN1CCC(CC1)c1cc(OC2CC2)c(Nc2ncc(Cl)c(Nc3cn(C)nc3C#N)n2)cc1C
Show InChI InChI=1S/C25H29ClN8O/c1-15-10-20(23(35-17-4-5-17)11-18(15)16-6-8-33(2)9-7-16)30-25-28-13-19(26)24(31-25)29-22-14-34(3)32-21(22)12-27/h10-11,13-14,16-17H,4-9H2,1-3H3,(H2,28,29,30,31)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159536
PNG
(CHEMBL3786916)
Show SMILES CC(C)S(=O)(=O)c1sc(C)nc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCN(C)CC2)ncc1Cl
Show InChI InChI=1S/C27H35ClN6O3S2/c1-15(2)39(35,36)26-25(30-17(4)38-26)32-24-21(28)14-29-27(33-24)31-22-12-16(3)20(13-23(22)37-19-6-7-19)18-8-10-34(5)11-9-18/h12-15,18-19H,6-11H2,1-5H3,(H2,29,31,32,33)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113507
PNG
(CHEMBL3604648)
Show SMILES CC(C)Oc1cc(C2CCN(C)C2)c(C)cc1Nc1ncc(Cl)c(Nc2cn(C)nc2S(=O)(=O)C(C)C)n1
Show InChI InChI=1S/C26H36ClN7O3S/c1-15(2)37-23-11-19(18-8-9-33(6)13-18)17(5)10-21(23)30-26-28-12-20(27)24(31-26)29-22-14-34(7)32-25(22)38(35,36)16(3)4/h10-12,14-16,18H,8-9,13H2,1-7H3,(H2,28,29,30,31)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of ALK L1196M mutant (unknown origin) using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113522
PNG
(CHEMBL3604642)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(F)c(cc2OC2CC2)C2CCN(C)CC2)ncc1Cl
Show InChI InChI=1S/C26H33ClFN7O3S/c1-15(2)39(36,37)25-22(14-35(4)33-25)30-24-19(27)13-29-26(32-24)31-21-12-20(28)18(11-23(21)38-17-5-6-17)16-7-9-34(3)10-8-16/h11-17H,5-10H2,1-4H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of ALK L1196M mutant (unknown origin) using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113626
PNG
(CHEMBL3604634)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCN(C)CC2)ncc1Cl
Show InChI InChI=1S/C27H36ClN7O3S/c1-16(2)39(36,37)26-23(15-35(5)33-26)30-25-21(28)14-29-27(32-25)31-22-12-17(3)20(13-24(22)38-19-6-7-19)18-8-10-34(4)11-9-18/h12-16,18-19H,6-11H2,1-5H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of ALK L1196M mutant (unknown origin) using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113627
PNG
(CHEMBL3604633)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCNCC2)ncc1Cl
Show InChI InChI=1S/C26H34ClN7O3S/c1-15(2)38(35,36)25-22(14-34(4)33-25)30-24-20(27)13-29-26(32-24)31-21-11-16(3)19(17-7-9-28-10-8-17)12-23(21)37-18-5-6-18/h11-15,17-18,28H,5-10H2,1-4H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of ALK L1196M mutant (unknown origin) using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113511
PNG
(CHEMBL3604655)
Show SMILES CCNC(=O)c1cc(OC2CC2)c(Nc2ncc(Cl)c(Nc3cn(C)nc3S(=O)(=O)C(C)C)n2)cc1C
Show InChI InChI=1S/C24H30ClN7O4S/c1-6-26-22(33)16-10-20(36-15-7-8-15)18(9-14(16)4)29-24-27-11-17(25)21(30-24)28-19-12-32(5)31-23(19)37(34,35)13(2)3/h9-13,15H,6-8H2,1-5H3,(H,26,33)(H2,27,28,29,30)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113516
PNG
(CHEMBL3604650)
Show SMILES COCCc1cc(OC2CC2)c(Nc2ncc(Cl)c(Nc3cn(C)nc3S(=O)(=O)C(C)C)n2)cc1C
Show InChI InChI=1S/C24H31ClN6O4S/c1-14(2)36(32,33)23-20(13-31(4)30-23)27-22-18(25)12-26-24(29-22)28-19-10-15(3)16(8-9-34-5)11-21(19)35-17-6-7-17/h10-14,17H,6-9H2,1-5H3,(H2,26,27,28,29)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113629
PNG
(CHEMBL3604632)
Show SMILES CC(C)Oc1cc(C2CCN(C)CC2)c(C)cc1Nc1ncc(Cl)c(Nc2cn(C)nc2S(=O)(=O)C(C)C)n1
Show InChI InChI=1S/C27H38ClN7O3S/c1-16(2)38-24-13-20(19-8-10-34(6)11-9-19)18(5)12-22(24)31-27-29-14-21(28)25(32-27)30-23-15-35(7)33-26(23)39(36,37)17(3)4/h12-17,19H,8-11H2,1-7H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PDB
Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113521
PNG
(CHEMBL3604643)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(Cl)c(cc2OC2CC2)C2CCN(C)CC2)ncc1Cl
Show InChI InChI=1S/C26H33Cl2N7O3S/c1-15(2)39(36,37)25-22(14-35(4)33-25)30-24-20(28)13-29-26(32-24)31-21-12-19(27)18(11-23(21)38-17-5-6-17)16-7-9-34(3)10-8-16/h11-17H,5-10H2,1-4H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113519
PNG
(CHEMBL3604645)
Show SMILES CC(C)Oc1cc(C2CNC2)c(C)cc1Nc1ncc(Cl)c(Nc2cn(C)nc2S(=O)(=O)C(C)C)n1
Show InChI InChI=1S/C24H32ClN7O3S/c1-13(2)35-21-8-17(16-9-26-10-16)15(5)7-19(21)29-24-27-11-18(25)22(30-24)28-20-12-32(6)31-23(20)36(33,34)14(3)4/h7-8,11-14,16,26H,9-10H2,1-6H3,(H2,27,28,29,30)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113517
PNG
(CHEMBL3604647)
Show SMILES CC(C)Oc1cc(C2CCNC2)c(C)cc1Nc1ncc(Cl)c(Nc2cn(C)nc2S(=O)(=O)C(C)C)n1
Show InChI InChI=1S/C25H34ClN7O3S/c1-14(2)36-22-10-18(17-7-8-27-11-17)16(5)9-20(22)30-25-28-12-19(26)23(31-25)29-21-13-33(6)32-24(21)37(34,35)15(3)4/h9-10,12-15,17,27H,7-8,11H2,1-6H3,(H2,28,29,30,31)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113626
PNG
(CHEMBL3604634)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCN(C)CC2)ncc1Cl
Show InChI InChI=1S/C27H36ClN7O3S/c1-16(2)39(36,37)26-23(15-35(5)33-26)30-25-21(28)14-29-27(32-25)31-22-12-17(3)20(13-24(22)38-19-6-7-19)18-8-10-34(4)11-9-18/h12-16,18-19H,6-11H2,1-5H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human ALK L1196M mutant using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159541
PNG
(CHEMBL3785890)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCN(C)CC2)ncc1C#N
Show InChI InChI=1S/C28H36N8O3S/c1-17(2)40(37,38)27-24(16-36(5)34-27)31-26-20(14-29)15-30-28(33-26)32-23-12-18(3)22(13-25(23)39-21-6-7-21)19-8-10-35(4)11-9-19/h12-13,15-17,19,21H,6-11H2,1-5H3,(H2,30,31,32,33)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human ALK L1196M mutant using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113514
PNG
(CHEMBL3604652)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(CCN(C)C)cc2OC2CC2)ncc1Cl
Show InChI InChI=1S/C25H34ClN7O3S/c1-15(2)37(34,35)24-21(14-33(6)31-24)28-23-19(26)13-27-25(30-23)29-20-11-16(3)17(9-10-32(4)5)12-22(20)36-18-7-8-18/h11-15,18H,7-10H2,1-6H3,(H2,27,28,29,30)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of ALK L1196M mutant (unknown origin) using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113508
PNG
(CHEMBL3604649)
Show SMILES CC(C)N1CCC(CC1)c1cc(OC2CC2)c(Nc2ncc(Cl)c(Nc3cn(C)nc3S(=O)(=O)C(C)C)n2)cc1C
Show InChI InChI=1S/C29H40ClN7O3S/c1-17(2)37-11-9-20(10-12-37)22-14-26(40-21-7-8-21)24(13-19(22)5)33-29-31-15-23(30)27(34-29)32-25-16-36(6)35-28(25)41(38,39)18(3)4/h13-18,20-21H,7-12H2,1-6H3,(H2,31,32,33,34)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of ALK L1196M mutant (unknown origin) using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113517
PNG
(CHEMBL3604647)
Show SMILES CC(C)Oc1cc(C2CCNC2)c(C)cc1Nc1ncc(Cl)c(Nc2cn(C)nc2S(=O)(=O)C(C)C)n1
Show InChI InChI=1S/C25H34ClN7O3S/c1-14(2)36-22-10-18(17-7-8-27-11-17)16(5)9-20(22)30-25-28-12-19(26)23(31-25)29-21-13-33(6)32-24(21)37(34,35)15(3)4/h9-10,12-15,17,27H,7-8,11H2,1-6H3,(H2,28,29,30,31)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of ALK L1196M mutant (unknown origin) using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113518
PNG
(CHEMBL3604646)
Show SMILES CC(C)Oc1cc(C2CN(C)C2)c(C)cc1Nc1ncc(Cl)c(Nc2cn(C)nc2S(=O)(=O)C(C)C)n1
Show InChI InChI=1S/C25H34ClN7O3S/c1-14(2)36-22-9-18(17-11-32(6)12-17)16(5)8-20(22)29-25-27-10-19(26)23(30-25)28-21-13-33(7)31-24(21)37(34,35)15(3)4/h8-10,13-15,17H,11-12H2,1-7H3,(H2,27,28,29,30)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of ALK L1196M mutant (unknown origin) using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113523
PNG
(CHEMBL3604641)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2ccc(cc2OC2CC2)C2CCN(C)CC2)ncc1Cl
Show InChI InChI=1S/C26H34ClN7O3S/c1-16(2)38(35,36)25-22(15-34(4)32-25)29-24-20(27)14-28-26(31-24)30-21-8-5-18(13-23(21)37-19-6-7-19)17-9-11-33(3)12-10-17/h5,8,13-17,19H,6-7,9-12H2,1-4H3,(H2,28,29,30,31)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of ALK L1196M mutant (unknown origin) using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159513
PNG
(CHEMBL3785825)
Show SMILES CC(C)N[C@H]1CC[C@H](CC1)c1cc(OC2CC2)c(Nc2ncc(Cl)c(Nc3cn(C)nc3S(=O)(=O)C(C)C)n2)cc1C
Show InChI InChI=1S/C30H42ClN7O3S/c1-17(2)33-21-9-7-20(8-10-21)23-14-27(41-22-11-12-22)25(13-19(23)5)35-30-32-15-24(31)28(36-30)34-26-16-38(6)37-29(26)42(39,40)18(3)4/h13-18,20-22,33H,7-12H2,1-6H3,(H2,32,34,35,36)/t20-,21+
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159517
PNG
(CHEMBL3785928)
Show SMILES CC(C)N[C@H]1CC[C@@H](CC1)c1cc(OC2CC2)c(Nc2ncc(Cl)c(Nc3cn(C)nc3S(=O)(=O)C(C)C)n2)cc1C
Show InChI InChI=1S/C30H42ClN7O3S/c1-17(2)33-21-9-7-20(8-10-21)23-14-27(41-22-11-12-22)25(13-19(23)5)35-30-32-15-24(31)28(36-30)34-26-16-38(6)37-29(26)42(39,40)18(3)4/h13-18,20-22,33H,7-12H2,1-6H3,(H2,32,34,35,36)/t20-,21-
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113511
PNG
(CHEMBL3604655)
Show SMILES CCNC(=O)c1cc(OC2CC2)c(Nc2ncc(Cl)c(Nc3cn(C)nc3S(=O)(=O)C(C)C)n2)cc1C
Show InChI InChI=1S/C24H30ClN7O4S/c1-6-26-22(33)16-10-20(36-15-7-8-15)18(9-14(16)4)29-24-27-11-17(25)21(30-24)28-19-12-32(5)31-23(19)37(34,35)13(2)3/h9-13,15H,6-8H2,1-5H3,(H,26,33)(H2,27,28,29,30)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 6n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of ALK L1196M mutant (unknown origin) using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113622
PNG
(CHEMBL3604638)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC(F)(F)F)C2CCN(C)CC2)ncc1Cl
Show InChI InChI=1S/C25H31ClF3N7O3S/c1-14(2)40(37,38)23-20(13-36(5)34-23)31-22-18(26)12-30-24(33-22)32-19-10-15(3)17(11-21(19)39-25(27,28)29)16-6-8-35(4)9-7-16/h10-14,16H,6-9H2,1-5H3,(H2,30,31,32,33)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 6n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159535
PNG
(CHEMBL3787297)
Show SMILES CC(C)S(=O)(=O)c1nc(C)sc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCN(C)CC2)ncc1Cl
Show InChI InChI=1S/C27H35ClN6O3S2/c1-15(2)39(35,36)26-25(38-17(4)30-26)32-24-21(28)14-29-27(33-24)31-22-12-16(3)20(13-23(22)37-19-6-7-19)18-8-10-34(5)11-9-18/h12-15,18-19H,6-11H2,1-5H3,(H2,29,31,32,33)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159537
PNG
(CHEMBL3785722)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCN(C)CC2)ncc1C
Show InChI InChI=1S/C28H39N7O3S/c1-17(2)39(36,37)27-24(16-35(6)33-27)30-26-19(4)15-29-28(32-26)31-23-13-18(3)22(14-25(23)38-21-7-8-21)20-9-11-34(5)12-10-20/h13-17,20-21H,7-12H2,1-6H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human ALK L1196M mutant using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113509
PNG
(CHEMBL3604631)
Show SMILES CC(C)Oc1cc(C2CCNCC2)c(C)cc1Nc1ncc(Cl)c(Nc2cn(C)nc2S(=O)(=O)C(C)C)n1
Show InChI InChI=1S/C26H36ClN7O3S/c1-15(2)37-23-12-19(18-7-9-28-10-8-18)17(5)11-21(23)31-26-29-13-20(27)24(32-26)30-22-14-34(6)33-25(22)38(35,36)16(3)4/h11-16,18,28H,7-10H2,1-6H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 6n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159518
PNG
(CHEMBL3786976)
Show SMILES CC(C)Oc1cc(C2CCNCC2)c(C)cc1Nc1ncc(Cl)c(Nc2cn(nc2S(=O)(=O)C(C)C)C2CC2)n1
Show InChI InChI=1S/C28H38ClN7O3S/c1-16(2)39-25-13-21(19-8-10-30-11-9-19)18(5)12-23(25)33-28-31-14-22(29)26(34-28)32-24-15-36(20-6-7-20)35-27(24)40(37,38)17(3)4/h12-17,19-20,30H,6-11H2,1-5H3,(H2,31,32,33,34)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113507
PNG
(CHEMBL3604648)
Show SMILES CC(C)Oc1cc(C2CCN(C)C2)c(C)cc1Nc1ncc(Cl)c(Nc2cn(C)nc2S(=O)(=O)C(C)C)n1
Show InChI InChI=1S/C26H36ClN7O3S/c1-15(2)37-23-11-19(18-8-9-33(6)13-18)17(5)10-21(23)30-26-28-12-20(27)24(31-26)29-22-14-34(7)32-25(22)38(35,36)16(3)4/h10-12,14-16,18H,8-9,13H2,1-7H3,(H2,28,29,30,31)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 7n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113510
PNG
(CHEMBL3604656)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)C2CCCN(C)C2)ncc1Cl
Show InChI InChI=1S/C27H36ClN7O3S/c1-16(2)39(36,37)26-23(15-35(5)33-26)30-25-21(28)13-29-27(32-25)31-22-11-17(3)20(12-24(22)38-19-8-9-19)18-7-6-10-34(4)14-18/h11-13,15-16,18-19H,6-10,14H2,1-5H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 7n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of ALK L1196M mutant (unknown origin) using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113516
PNG
(CHEMBL3604650)
Show SMILES COCCc1cc(OC2CC2)c(Nc2ncc(Cl)c(Nc3cn(C)nc3S(=O)(=O)C(C)C)n2)cc1C
Show InChI InChI=1S/C24H31ClN6O4S/c1-14(2)36(32,33)23-20(13-31(4)30-23)27-22-18(25)12-26-24(29-22)28-19-10-15(3)16(8-9-34-5)11-21(19)35-17-6-7-17/h10-14,17H,6-9H2,1-5H3,(H2,26,27,28,29)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 7n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of ALK L1196M mutant (unknown origin) using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50157641
PNG
(CHEMBL3787658)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC2CC2)[C@H]2CC[C@@H](CC2)N2CCN(CC2)C(C)=O)ncc1Cl
Show InChI InChI=1S/C33H45ClN8O4S/c1-20(2)47(44,45)32-29(19-40(5)39-32)36-31-27(34)18-35-33(38-31)37-28-16-21(3)26(17-30(28)46-25-10-11-25)23-6-8-24(9-7-23)42-14-12-41(13-15-42)22(4)43/h16-20,23-25H,6-15H2,1-5H3,(H2,35,36,37,38)/t23-,24-
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human ALK L1196M mutant using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159522
PNG
(CHEMBL3785711)
Show SMILES CC(C)CS(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C)c(cc2OC(C)C)C2CCNCC2)ncc1Cl
Show InChI InChI=1S/C27H38ClN7O3S/c1-16(2)15-39(36,37)26-23(14-35(6)34-26)31-25-21(28)13-30-27(33-25)32-22-11-18(5)20(12-24(22)38-17(3)4)19-7-9-29-10-8-19/h11-14,16-17,19,29H,7-10,15H2,1-6H3,(H2,30,31,32,33)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 7n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human ALK L1196M mutant using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113509
PNG
(CHEMBL3604631)
Show SMILES CC(C)Oc1cc(C2CCNCC2)c(C)cc1Nc1ncc(Cl)c(Nc2cn(C)nc2S(=O)(=O)C(C)C)n1
Show InChI InChI=1S/C26H36ClN7O3S/c1-15(2)37-23-12-19(18-7-9-28-10-8-18)17(5)11-21(23)31-26-29-13-20(27)24(32-26)30-22-14-34(6)33-25(22)38(35,36)16(3)4/h11-16,18,28H,7-10H2,1-6H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 8n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113629
PNG
(CHEMBL3604632)
Show SMILES CC(C)Oc1cc(C2CCN(C)CC2)c(C)cc1Nc1ncc(Cl)c(Nc2cn(C)nc2S(=O)(=O)C(C)C)n1
Show InChI InChI=1S/C27H38ClN7O3S/c1-16(2)38-24-13-20(19-8-10-34(6)11-9-19)18(5)12-22(24)31-27-29-14-21(28)25(32-27)30-23-15-35(7)33-26(23)39(36,37)17(3)4/h12-17,19H,8-11H2,1-7H3,(H2,29,30,31,32)
PDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

PDB
Article
PubMed
n/an/a 8n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of ALK L1196M mutant (unknown origin) using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50113520
PNG
(CHEMBL3604644)
Show SMILES CC(C)S(=O)(=O)c1nn(C)cc1Nc1nc(Nc2cc(C#N)c(cc2OC2CC2)C2CCN(C)CC2)ncc1Cl
Show InChI InChI=1S/C27H33ClN8O3S/c1-16(2)40(37,38)26-23(15-36(4)34-26)31-25-21(28)14-30-27(33-25)32-22-11-18(13-29)20(12-24(22)39-19-5-6-19)17-7-9-35(3)10-8-17/h11-12,14-17,19H,5-10H2,1-4H3,(H2,30,31,32,33)
PDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 8n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant ALK using TK substrate-biotin incubated for 30 mins by HTRF assay


Bioorg Med Chem Lett 25: 3738-43 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.021
BindingDB Entry DOI: 10.7270/Q208674B
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50159523
PNG
(CHEMBL3786173)
Show SMILES CCN(CC)[C@H]1CC[C@H](CC1)c1cc(OC2CC2)c(Nc2ncc(Cl)c(Nc3cn(C)nc3S(=O)(=O)C(C)C)n2)cc1C
Show InChI InChI=1S/C31H44ClN7O3S/c1-7-39(8-2)22-11-9-21(10-12-22)24-16-28(42-23-13-14-23)26(15-20(24)5)35-31-33-17-25(32)29(36-31)34-27-18-38(6)37-30(27)43(40,41)19(3)4/h15-19,21-23H,7-14H2,1-6H3,(H2,33,34,35,36)/t21-,22+
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8n/an/an/an/an/an/a



Beijing Pearl Biotech Ltd

Curated by ChEMBL


Assay Description
Inhibition of recombinant human wild type ALK using tyrosine kinase substrate-biotin after 30 mins by HTRF assay


Bioorg Med Chem Lett 26: 1910-8 (2016)


Article DOI: 10.1016/j.bmcl.2016.03.017
BindingDB Entry DOI: 10.7270/Q26M38QJ
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 112 total )  |  Next  |  Last  >>
Jump to: