Found 41 hits Enz. Inhib. hit(s) with all data for entry = 50000717 Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50252729
((2''Z-3''E)-6-Bromoindirubin-3''-(O-{2-[4-(2-hydro...)Show SMILES Cl.Cl.Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCNCC1 Show InChI InChI=1S/C24H26BrN5O3/c25-16-5-6-17-20(15-16)27-24(32)21(17)23-22(18-3-1-2-4-19(18)26-23)28-33-14-12-30-9-7-29(8-10-30)11-13-31/h1-6,15,26,31H,7-14H2,(H,27,32)/b23-21-,28-22+ | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | <0.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant c-Src (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50252727
((2'Z-3'E)-6-Bromoindirubin-3'-(O-{2-[N-methyl,N-(2...)Show SMILES CN(CCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2cc(Br)ccc12)CC(O)CO Show InChI InChI=1S/C22H23BrN4O4/c1-27(11-14(29)12-28)8-9-31-26-20-16-4-2-3-5-17(16)24-21(20)19-15-7-6-13(23)10-18(15)25-22(19)30/h2-7,10,14,24,28-29H,8-9,11-12H2,1H3,(H,25,30)/b21-19-,26-20+ | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | <0.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant c-Src (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50252727
((2'Z-3'E)-6-Bromoindirubin-3'-(O-{2-[N-methyl,N-(2...)Show SMILES CN(CCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2cc(Br)ccc12)CC(O)CO Show InChI InChI=1S/C22H23BrN4O4/c1-27(11-14(29)12-28)8-9-31-26-20-16-4-2-3-5-17(16)24-21(20)19-15-7-6-13(23)10-18(15)25-22(19)30/h2-7,10,14,24,28-29H,8-9,11-12H2,1H3,(H,25,30)/b21-19-,26-20+ | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.610 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant c-Src (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50252767
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-{4-[2-(2-hydro...)Show SMILES Cl.Cl.OCCOCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C26H30BrN5O4/c27-18-5-6-19-22(17-18)29-26(34)23(19)25-24(20-3-1-2-4-21(20)28-25)30-36-15-12-32-9-7-31(8-10-32)11-14-35-16-13-33/h1-6,17,28,33H,7-16H2,(H,29,34)/b25-23-,30-24+ | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.830 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant c-Src (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50252729
((2''Z-3''E)-6-Bromoindirubin-3''-(O-{2-[4-(2-hydro...)Show SMILES Cl.Cl.Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCNCC1 Show InChI InChI=1S/C24H26BrN5O3/c25-16-5-6-17-20(15-16)27-24(32)21(17)23-22(18-3-1-2-4-19(18)26-23)28-33-14-12-30-9-7-29(8-10-30)11-13-31/h1-6,15,26,31H,7-14H2,(H,27,32)/b23-21-,28-22+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 0.870 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50252978
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-pyrrolidin-1-y...)Show SMILES Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCCC1 Show InChI InChI=1S/C22H21BrN4O2/c23-14-7-8-15-18(13-14)25-22(28)19(15)21-20(16-5-1-2-6-17(16)24-21)26-29-12-11-27-9-3-4-10-27/h1-2,5-8,13,24H,3-4,9-12H2,(H,25,28)/b21-19-,26-20+ | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant c-Src (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50259591
(CHEMBL493656)Show SMILES COCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C25H28BrN5O3/c1-33-14-12-30-8-10-31(11-9-30)13-15-34-29-23-19-4-2-3-5-20(19)27-24(23)22-18-7-6-17(26)16-21(18)28-25(22)32/h2-7,16,27H,8-15H2,1H3,(H,28,32)/b24-22-,29-23+ | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant c-Src (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50259591
(CHEMBL493656)Show SMILES COCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C25H28BrN5O3/c1-33-14-12-30-8-10-31(11-9-30)13-15-34-29-23-19-4-2-3-5-20(19)27-24(23)22-18-7-6-17(26)16-21(18)28-25(22)32/h2-7,16,27H,8-15H2,1H3,(H,28,32)/b24-22-,29-23+ | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant c-Src (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50252978
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-pyrrolidin-1-y...)Show SMILES Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCCC1 Show InChI InChI=1S/C22H21BrN4O2/c23-14-7-8-15-18(13-14)25-22(28)19(15)21-20(16-5-1-2-6-17(16)24-21)26-29-12-11-27-9-3-4-10-27/h1-2,5-8,13,24H,3-4,9-12H2,(H,25,28)/b21-19-,26-20+ | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.90 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant c-Src (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Aurora kinase A
(Homo sapiens (Human)) | BDBM50252729
((2''Z-3''E)-6-Bromoindirubin-3''-(O-{2-[4-(2-hydro...)Show SMILES Cl.Cl.Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCNCC1 Show InChI InChI=1S/C24H26BrN5O3/c25-16-5-6-17-20(15-16)27-24(32)21(17)23-22(18-3-1-2-4-19(18)26-23)28-33-14-12-30-9-7-29(8-10-30)11-13-31/h1-6,15,26,31H,7-14H2,(H,27,32)/b23-21-,28-22+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Aurora A (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50252727
((2'Z-3'E)-6-Bromoindirubin-3'-(O-{2-[N-methyl,N-(2...)Show SMILES CN(CCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2cc(Br)ccc12)CC(O)CO Show InChI InChI=1S/C22H23BrN4O4/c1-27(11-14(29)12-28)8-9-31-26-20-16-4-2-3-5-17(16)24-21(20)19-15-7-6-13(23)10-18(15)25-22(19)30/h2-7,10,14,24,28-29H,8-9,11-12H2,1H3,(H,25,30)/b21-19-,26-20+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50252727
((2'Z-3'E)-6-Bromoindirubin-3'-(O-{2-[N-methyl,N-(2...)Show SMILES CN(CCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2cc(Br)ccc12)CC(O)CO Show InChI InChI=1S/C22H23BrN4O4/c1-27(11-14(29)12-28)8-9-31-26-20-16-4-2-3-5-17(16)24-21(20)19-15-7-6-13(23)10-18(15)25-22(19)30/h2-7,10,14,24,28-29H,8-9,11-12H2,1H3,(H,25,30)/b21-19-,26-20+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50252729
((2''Z-3''E)-6-Bromoindirubin-3''-(O-{2-[4-(2-hydro...)Show SMILES Cl.Cl.Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCNCC1 Show InChI InChI=1S/C24H26BrN5O3/c25-16-5-6-17-20(15-16)27-24(32)21(17)23-22(18-3-1-2-4-19(18)26-23)28-33-14-12-30-9-7-29(8-10-30)11-13-31/h1-6,15,26,31H,7-14H2,(H,27,32)/b23-21-,28-22+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 9.40 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 T315I mutant (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Aurora kinase A
(Homo sapiens (Human)) | BDBM50252767
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-{4-[2-(2-hydro...)Show SMILES Cl.Cl.OCCOCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C26H30BrN5O4/c27-18-5-6-19-22(17-18)29-26(34)23(19)25-24(20-3-1-2-4-21(20)28-25)30-36-15-12-32-9-7-31(8-10-32)11-14-35-16-13-33/h1-6,17,28,33H,7-16H2,(H,29,34)/b25-23-,30-24+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Aurora A (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50252767
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-{4-[2-(2-hydro...)Show SMILES Cl.Cl.OCCOCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C26H30BrN5O4/c27-18-5-6-19-22(17-18)29-26(34)23(19)25-24(20-3-1-2-4-21(20)28-25)30-36-15-12-32-9-7-31(8-10-32)11-14-35-16-13-33/h1-6,17,28,33H,7-16H2,(H,29,34)/b25-23-,30-24+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 34 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibitory constant against Serotonin transporter |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50252767
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-{4-[2-(2-hydro...)Show SMILES Cl.Cl.OCCOCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C26H30BrN5O4/c27-18-5-6-19-22(17-18)29-26(34)23(19)25-24(20-3-1-2-4-21(20)28-25)30-36-15-12-32-9-7-31(8-10-32)11-14-35-16-13-33/h1-6,17,28,33H,7-16H2,(H,29,34)/b25-23-,30-24+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 34.1 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Aurora kinase A
(Homo sapiens (Human)) | BDBM50252727
((2'Z-3'E)-6-Bromoindirubin-3'-(O-{2-[N-methyl,N-(2...)Show SMILES CN(CCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2cc(Br)ccc12)CC(O)CO Show InChI InChI=1S/C22H23BrN4O4/c1-27(11-14(29)12-28)8-9-31-26-20-16-4-2-3-5-17(16)24-21(20)19-15-7-6-13(23)10-18(15)25-22(19)30/h2-7,10,14,24,28-29H,8-9,11-12H2,1H3,(H,25,30)/b21-19-,26-20+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 41.5 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Aurora A (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Aurora kinase A
(Homo sapiens (Human)) | BDBM50252727
((2'Z-3'E)-6-Bromoindirubin-3'-(O-{2-[N-methyl,N-(2...)Show SMILES CN(CCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2cc(Br)ccc12)CC(O)CO Show InChI InChI=1S/C22H23BrN4O4/c1-27(11-14(29)12-28)8-9-31-26-20-16-4-2-3-5-17(16)24-21(20)19-15-7-6-13(23)10-18(15)25-22(19)30/h2-7,10,14,24,28-29H,8-9,11-12H2,1H3,(H,25,30)/b21-19-,26-20+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 42 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Aurora A (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50252978
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-pyrrolidin-1-y...)Show SMILES Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCCC1 Show InChI InChI=1S/C22H21BrN4O2/c23-14-7-8-15-18(13-14)25-22(28)19(15)21-20(16-5-1-2-6-17(16)24-21)26-29-12-11-27-9-3-4-10-27/h1-2,5-8,13,24H,3-4,9-12H2,(H,25,28)/b21-19-,26-20+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 67 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Aurora kinase A
(Homo sapiens (Human)) | BDBM50252978
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-pyrrolidin-1-y...)Show SMILES Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCCC1 Show InChI InChI=1S/C22H21BrN4O2/c23-14-7-8-15-18(13-14)25-22(28)19(15)21-20(16-5-1-2-6-17(16)24-21)26-29-12-11-27-9-3-4-10-27/h1-2,5-8,13,24H,3-4,9-12H2,(H,25,28)/b21-19-,26-20+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 79 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Aurora A (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50252978
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-pyrrolidin-1-y...)Show SMILES Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCCC1 Show InChI InChI=1S/C22H21BrN4O2/c23-14-7-8-15-18(13-14)25-22(28)19(15)21-20(16-5-1-2-6-17(16)24-21)26-29-12-11-27-9-3-4-10-27/h1-2,5-8,13,24H,3-4,9-12H2,(H,25,28)/b21-19-,26-20+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 107 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Aurora kinase A
(Homo sapiens (Human)) | BDBM50252978
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-pyrrolidin-1-y...)Show SMILES Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCCC1 Show InChI InChI=1S/C22H21BrN4O2/c23-14-7-8-15-18(13-14)25-22(28)19(15)21-20(16-5-1-2-6-17(16)24-21)26-29-12-11-27-9-3-4-10-27/h1-2,5-8,13,24H,3-4,9-12H2,(H,25,28)/b21-19-,26-20+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 175 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Aurora A (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50252727
((2'Z-3'E)-6-Bromoindirubin-3'-(O-{2-[N-methyl,N-(2...)Show SMILES CN(CCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2cc(Br)ccc12)CC(O)CO Show InChI InChI=1S/C22H23BrN4O4/c1-27(11-14(29)12-28)8-9-31-26-20-16-4-2-3-5-17(16)24-21(20)19-15-7-6-13(23)10-18(15)25-22(19)30/h2-7,10,14,24,28-29H,8-9,11-12H2,1H3,(H,25,30)/b21-19-,26-20+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 178 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 T315I mutant (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50252727
((2'Z-3'E)-6-Bromoindirubin-3'-(O-{2-[N-methyl,N-(2...)Show SMILES CN(CCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2cc(Br)ccc12)CC(O)CO Show InChI InChI=1S/C22H23BrN4O4/c1-27(11-14(29)12-28)8-9-31-26-20-16-4-2-3-5-17(16)24-21(20)19-15-7-6-13(23)10-18(15)25-22(19)30/h2-7,10,14,24,28-29H,8-9,11-12H2,1H3,(H,25,30)/b21-19-,26-20+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 194 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 T315I mutant (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Proto-oncogene tyrosine-protein kinase Src
(Homo sapiens (Human)) | BDBM50259592
(CHEMBL4080255)Show SMILES Cl.Cl.Brc1cccc2\C(C(=O)Nc12)=C1\Nc2ccccc2\C\1=N/OCCN1CCNCC1 Show InChI InChI=1S/C22H22BrN5O2/c23-16-6-3-5-15-18(22(29)26-19(15)16)21-20(14-4-1-2-7-17(14)25-21)27-30-13-12-28-10-8-24-9-11-28/h1-7,24-25H,8-13H2,(H,26,29)/b21-18-,27-20+ | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant GST-tagged c-Src (unknown origin) expressed in insect cells using pEY as substrate preincubated with enzyme followed by [33... |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50252729
((2''Z-3''E)-6-Bromoindirubin-3''-(O-{2-[4-(2-hydro...)Show SMILES Cl.Cl.Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCNCC1 Show InChI InChI=1S/C24H26BrN5O3/c25-16-5-6-17-20(15-16)27-24(32)21(17)23-22(18-3-1-2-4-19(18)26-23)28-33-14-12-30-9-7-29(8-10-30)11-13-31/h1-6,15,26,31H,7-14H2,(H,27,32)/b23-21-,28-22+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 224 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant JAK2 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Aurora kinase A
(Homo sapiens (Human)) | BDBM50259591
(CHEMBL493656)Show SMILES COCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C25H28BrN5O3/c1-33-14-12-30-8-10-31(11-9-30)13-15-34-29-23-19-4-2-3-5-20(19)27-24(23)22-18-7-6-17(26)16-21(18)28-25(22)32/h2-7,16,27H,8-15H2,1H3,(H,28,32)/b24-22-,29-23+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 330 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Aurora A (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50259591
(CHEMBL493656)Show SMILES COCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C25H28BrN5O3/c1-33-14-12-30-8-10-31(11-9-30)13-15-34-29-23-19-4-2-3-5-20(19)27-24(23)22-18-7-6-17(26)16-21(18)28-25(22)32/h2-7,16,27H,8-15H2,1H3,(H,28,32)/b24-22-,29-23+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 468 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50252727
((2'Z-3'E)-6-Bromoindirubin-3'-(O-{2-[N-methyl,N-(2...)Show SMILES CN(CCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2cc(Br)ccc12)CC(O)CO Show InChI InChI=1S/C22H23BrN4O4/c1-27(11-14(29)12-28)8-9-31-26-20-16-4-2-3-5-17(16)24-21(20)19-15-7-6-13(23)10-18(15)25-22(19)30/h2-7,10,14,24,28-29H,8-9,11-12H2,1H3,(H,25,30)/b21-19-,26-20+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 551 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant JAK2 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50252727
((2'Z-3'E)-6-Bromoindirubin-3'-(O-{2-[N-methyl,N-(2...)Show SMILES CN(CCO\N=C1\C(\Nc2ccccc\12)=C1\C(=O)Nc2cc(Br)ccc12)CC(O)CO Show InChI InChI=1S/C22H23BrN4O4/c1-27(11-14(29)12-28)8-9-31-26-20-16-4-2-3-5-17(16)24-21(20)19-15-7-6-13(23)10-18(15)25-22(19)30/h2-7,10,14,24,28-29H,8-9,11-12H2,1H3,(H,25,30)/b21-19-,26-20+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 589 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant JAK2 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50259591
(CHEMBL493656)Show SMILES COCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C25H28BrN5O3/c1-33-14-12-30-8-10-31(11-9-30)13-15-34-29-23-19-4-2-3-5-20(19)27-24(23)22-18-7-6-17(26)16-21(18)28-25(22)32/h2-7,16,27H,8-15H2,1H3,(H,28,32)/b24-22-,29-23+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.44E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50252978
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-pyrrolidin-1-y...)Show SMILES Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCCC1 Show InChI InChI=1S/C22H21BrN4O2/c23-14-7-8-15-18(13-14)25-22(28)19(15)21-20(16-5-1-2-6-17(16)24-21)26-29-12-11-27-9-3-4-10-27/h1-2,5-8,13,24H,3-4,9-12H2,(H,25,28)/b21-19-,26-20+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.41E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant JAK2 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50252978
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-pyrrolidin-1-y...)Show SMILES Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCCC1 Show InChI InChI=1S/C22H21BrN4O2/c23-14-7-8-15-18(13-14)25-22(28)19(15)21-20(16-5-1-2-6-17(16)24-21)26-29-12-11-27-9-3-4-10-27/h1-2,5-8,13,24H,3-4,9-12H2,(H,25,28)/b21-19-,26-20+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.56E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 T315I mutant (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50252978
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-pyrrolidin-1-y...)Show SMILES Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCCC1 Show InChI InChI=1S/C22H21BrN4O2/c23-14-7-8-15-18(13-14)25-22(28)19(15)21-20(16-5-1-2-6-17(16)24-21)26-29-12-11-27-9-3-4-10-27/h1-2,5-8,13,24H,3-4,9-12H2,(H,25,28)/b21-19-,26-20+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 5.94E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 T315I mutant (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50252978
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-pyrrolidin-1-y...)Show SMILES Brc1ccc2\C(C(=O)Nc2c1)=C1\Nc2ccccc2\C\1=N/OCCN1CCCC1 Show InChI InChI=1S/C22H21BrN4O2/c23-14-7-8-15-18(13-14)25-22(28)19(15)21-20(16-5-1-2-6-17(16)24-21)26-29-12-11-27-9-3-4-10-27/h1-2,5-8,13,24H,3-4,9-12H2,(H,25,28)/b21-19-,26-20+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 7.46E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibitory constant against Serotonin transporter |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50259591
(CHEMBL493656)Show SMILES COCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C25H28BrN5O3/c1-33-14-12-30-8-10-31(11-9-30)13-15-34-29-23-19-4-2-3-5-20(19)27-24(23)22-18-7-6-17(26)16-21(18)28-25(22)32/h2-7,16,27H,8-15H2,1H3,(H,28,32)/b24-22-,29-23+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibitory constant against Serotonin transporter |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50259591
(CHEMBL493656)Show SMILES COCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C25H28BrN5O3/c1-33-14-12-30-8-10-31(11-9-30)13-15-34-29-23-19-4-2-3-5-20(19)27-24(23)22-18-7-6-17(26)16-21(18)28-25(22)32/h2-7,16,27H,8-15H2,1H3,(H,28,32)/b24-22-,29-23+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant JAK2 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase JAK2
(Homo sapiens (Human)) | BDBM50252767
((2'Z-3'E)-6-Bromoindirubin-3'-[O-(2-{4-[2-(2-hydro...)Show SMILES Cl.Cl.OCCOCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C26H30BrN5O4/c27-18-5-6-19-22(17-18)29-26(34)23(19)25-24(20-3-1-2-4-21(20)28-25)30-36-15-12-32-9-7-31(8-10-32)11-14-35-16-13-33/h1-6,17,28,33H,7-16H2,(H,29,34)/b25-23-,30-24+ | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant JAK2 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Aurora kinase A
(Homo sapiens (Human)) | BDBM50259591
(CHEMBL493656)Show SMILES COCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C25H28BrN5O3/c1-33-14-12-30-8-10-31(11-9-30)13-15-34-29-23-19-4-2-3-5-20(19)27-24(23)22-18-7-6-17(26)16-21(18)28-25(22)32/h2-7,16,27H,8-15H2,1H3,(H,28,32)/b24-22-,29-23+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant Aurora A (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50259591
(CHEMBL493656)Show SMILES COCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C25H28BrN5O3/c1-33-14-12-30-8-10-31(11-9-30)13-15-34-29-23-19-4-2-3-5-20(19)27-24(23)22-18-7-6-17(26)16-21(18)28-25(22)32/h2-7,16,27H,8-15H2,1H3,(H,28,32)/b24-22-,29-23+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
Tyrosine-protein kinase ABL1
(Homo sapiens (Human)) | BDBM50259591
(CHEMBL493656)Show SMILES COCCN1CCN(CCO\N=C2\C(\Nc3ccccc\23)=C2\C(=O)Nc3cc(Br)ccc23)CC1 Show InChI InChI=1S/C25H28BrN5O3/c1-33-14-12-30-8-10-31(11-9-30)13-15-34-29-23-19-4-2-3-5-20(19)27-24(23)22-18-7-6-17(26)16-21(18)28-25(22)32/h2-7,16,27H,8-15H2,1H3,(H,28,32)/b24-22-,29-23+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Beckman Research Institute
Curated by ChEMBL
| Assay Description
Inhibition of recombinant ABL1 T315I mutant (unknown origin) after 120 mins in presence of [33P]ATP |
J Nat Prod 79: 2464-2471 (2016)
Article DOI: 10.1021/acs.jnatprod.6b00285
BindingDB Entry DOI: 10.7270/Q2GF0WZR |
More data for this
Ligand-Target Pair | |
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