BindingDB BDBM50095952 CHEMBL3593777

BDBM50095952 CHEMBL3593777

SMILES NC(=O)c1cnc2[nH]ccc2c1N[C@@H]1CCN(C[C@@H]1F)c1ccc(cn1)C#N

InChI Key InChIKey=QZIQXTJSJONATN-ZCUDWAKFSA-N

Data 40 IC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 40 hits for monomerid = 50095952

Potassium voltage-gated channel subfamily H member 2(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+5nMAssay Description:Inhibition of human ERG expressed in CHOK1 cells incubated for 10 mins by Rb efflux assayMore data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Tyrosine-protein kinase JAK1(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 4.10nMAssay Description:Inhibition of human JAK1 assessed as reduction in phosphorylation of Biotin-Lyn-Substrate-2 after 1 hr in presence of ATP by ELISAMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Tyrosine-protein kinase JAK1(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 4.10nMAssay Description:Inhibition of human JAK1 kinase domain using biotin-Lyn-substrate-2 as substrate incubated for 1 hr by ELISA methodMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Tyrosine-protein kinase JAK3(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 0.300nMAssay Description:Inhibition of human JAK3 kinase domain using biotin-Lyn-substrate-2 as substrate incubated for 1 hr by ELISA methodMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Ephrin type-A receptor 2(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of EPHA2 (unknown origin)More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Tyrosine-protein kinase Tec(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of TEC (unknown origin)More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Tyrosine-protein kinase BTK(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of BTK (unknown origin)More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Tyrosine-protein kinase ITK/TSK(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of ITK (unknown origin)More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Tyrosine-protein kinase SYK(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of SYK (unknown origin)More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Tyrosine-protein kinase ZAP-70(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of ZAP70 (unknown origin)More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Tyrosine-protein kinase ABL1(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of ABL (unknown origin)More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Tyrosine-protein kinase CSK(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of CSK (unknown origin)More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Focal adhesion kinase 1(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of FAK (unknown origin)More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Mitogen-activated protein kinase 10(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 560nMAssay Description:Inhibition of JNK3 (unknown origin)More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 590nMAssay Description:Inhibition of CDK2/CycA (unknown origin)More data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia antibodypedia antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Glycogen synthase kinase-3 beta(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 980nMAssay Description:Inhibition of GSK3beta (unknown origin)More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Calcium/calmodulin-dependent protein kinase type II subunit alpha(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 1.00E+3nMAssay Description:Inhibition of CaMK2a (unknown origin)More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Serine/threonine-protein kinase Chk1(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 950nMAssay Description:Inhibition of CHK1 (unknown origin)More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Rho-associated protein kinase 1(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 190nMAssay Description:Inhibition of ROCK1 (unknown origin)More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Protein kinase C alpha type(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 130nMAssay Description:Inhibition of PKCalpha (unknown origin)More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Protein kinase C theta type(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 320nMAssay Description:Inhibition of PKCtheta (unknown origin)More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Ribosomal protein S6 kinase beta-1(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of p70S6K (unknown origin)More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Aurora kinase C(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of AurC (unknown origin)More data for this Ligand-Target Pair

PDB NCI pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

RAC-alpha serine/threonine-protein kinase(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of AKT1 (unknown origin)More data for this Ligand-Target Pair

PDB Reactome pathway
UniProtKB/SwissProt
antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Casein kinase I isoform delta(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of CK1delta (unknown origin)More data for this Ligand-Target Pair

PDB Reactome pathway
UniProtKB/SwissProt
B.MOAD GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Mitogen-activated protein kinase kinase kinase 1(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of MEKK1 (unknown origin)More data for this Ligand-Target Pair

PDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Dual specificity mitogen-activated protein kinase kinase 1(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of MEK1 (unknown origin)More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

RAF proto-oncogene serine/threonine-protein kinase(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of RAF1 (unknown origin)More data for this Ligand-Target Pair

PDB MMDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Mitogen-activated protein kinase kinase kinase 9(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 51nMAssay Description:Inhibition of MLK1 (unknown origin)More data for this Ligand-Target Pair

PDB KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Bone morphogenetic protein receptor type-1A(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of BMPR1A (unknown origin)More data for this Ligand-Target Pair

PDB Reactome pathway
UniProtKB/SwissProt
antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Interleukin-1 receptor-associated kinase 4(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of IRAK4 (unknown origin)More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Receptor tyrosine-protein kinase erbB-2(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of HER2 (unknown origin)More data for this Ligand-Target Pair

PDB MMDB Reactome pathway
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Insulin-like growth factor 1 receptor(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of IGF1R (unknown origin)More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Angiopoietin-1 receptor(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of TIE2 (unknown origin)More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

High affinity nerve growth factor receptor(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 470nMAssay Description:Inhibition of TRKA (unknown origin)More data for this Ligand-Target Pair

PDB MMDB Reactome pathway
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Epidermal growth factor receptor(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+3nMAssay Description:Inhibition of EGFR (unknown origin)More data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Tyrosine-protein kinase JAK2(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 3.20nMAssay Description:Inhibition of human JAK2 assessed as reduction in phosphorylation of Biotin-Lyn-Substrate-2 after 1 hr in presence of ATP by ELISAMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Potassium voltage-gated channel subfamily H member 2(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: >1.00E+5nMAssay Description:Inhibition of human ERG expressed in CHO-K1 cells after 10 mins by Rb efflux assayMore data for this Ligand-Target Pair

PDB MMDB Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Tyrosine-protein kinase JAK3(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 0.300nMAssay Description:Inhibition of human JAK3 assessed as reduction in phosphorylation of Biotin-Lyn-Substrate-2 after 1 hr in presence of ATP by ELISAMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Tyrosine-protein kinase JAK2(Homo sapiens (Human))
Astellas Pharma

Curated by ChEMBL

BDBM50095952(CHEMBL3593777)

IC50: 3.20nMAssay Description:Inhibition of human JAK2 kinase domain using biotin-Lyn-substrate-2 as substrate incubated for 1 hr by ELISA methodMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Filter my 40 hits

Targets 36▿
- Tyrosine-protein kinase JAK3 2
- Tyrosine-protein kinase JAK2 2
- Tyrosine-protein kinase JAK1 2
- Potassium voltage-gated channel subfamily H member 2 2
- Ephrin type-A receptor 2 1
- Tyrosine-protein kinase Tec 1
- Tyrosine-protein kinase BTK 1
- Tyrosine-protein kinase ITK/TSK 1
- Insulin-like growth factor 1 receptor 1
- High affinity nerve growth factor receptor 1
- Bone morphogenetic protein receptor type-1A 1
- Receptor tyrosine-protein kinase erbB-2 1
- Epidermal growth factor receptor 1
- Cyclin-A1/Cyclin-A2/Cyclin-dependent kinase 2 1
- Tyrosine-protein kinase SYK 1
- Angiopoietin-1 receptor 1
- Ribosomal protein S6 kinase beta-1 1
- Glycogen synthase kinase-3 beta 1
- Aurora kinase C 1
- Interleukin-1 receptor-associated kinase 4 1
- Mitogen-activated protein kinase kinase kinase 9 1
- Casein kinase I isoform delta 1
- Mitogen-activated protein kinase 10 1
- Tyrosine-protein kinase ABL1 1
- Mitogen-activated protein kinase kinase kinase 1 1
- Tyrosine-protein kinase CSK 1
- RAF proto-oncogene serine/threonine-protein kinase 1
- Protein kinase C alpha type 1
- Protein kinase C theta type 1
- Focal adhesion kinase 1 1
- RAC-alpha serine/threonine-protein kinase 1
- Calcium/calmodulin-dependent protein kinase type II subunit alpha 1
- Serine/threonine-protein kinase Chk1 1
- Dual specificity mitogen-activated protein kinase kinase 1 1
- Tyrosine-protein kinase ZAP-70 1
- Rho-associated protein kinase 1 1
Publications 2▿
- Bioorg Med Chem 23: 4871-83 (2015) 36
- Bioorg Med Chem 24: 4711-4722 (2016) 4
Institutions 1▿
- Astellas Pharma 40
Affinity: 0.30 to 1.0E+5 nM▿
- IC50 40
- Affinity ≤ nM
Xtal structures: 0
Docked structures: 0
Catalog Cmpds: 0