BDBM7364 6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 38::7-butyl-6-(4-methoxyphenyl)-5H-pyrrolo[2,3-b]pyrazine::7-n-Butyl-6-(4-methoxyphenyl)[5H]pyrrolo[2,3-b]pyrazine
SMILES: CCCCc1c([nH]c2nccnc12)-c1ccc(OC)cc1
InChI Key: InChIKey=WVMANZPBOBRWCB-UHFFFAOYSA-N
PDB links: 1 PDB ID contains inhibitors having a similarity of 90% to this monomer.
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Protein-tyrosine kinase 2-beta (Homo sapiens (Human)) | BDBM7364 (6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 38 |...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Similars | Article PubMed | 933 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Sandia National Laboratories Curated by ChEMBL | Assay Description Inhibition of human recombinant PYK2 by ESI-MS analysis | J Med Chem 55: 1926-39 (2012) Article DOI: 10.1021/jm200979x BindingDB Entry DOI: 10.7270/Q2R212DQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Tyrosine-protein kinase ZAP-70 (Homo sapiens (Human)) | BDBM7364 (6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 38 |...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Similars | Article PubMed | 2.63E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Sandia National Laboratories Curated by ChEMBL | Assay Description Inhibition of human recombinant ZAP70 using EEEEYEEEE as substrate by ESI-MS analysis | J Med Chem 55: 1926-39 (2012) Article DOI: 10.1021/jm200979x BindingDB Entry DOI: 10.7270/Q2R212DQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Glycogen synthase kinase-3 alpha/beta (Homo sapiens (Human)) | BDBM7364 (6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 38 |...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 912 | n/a | n/a | n/a | n/a | n/a | n/a |
Zhejiang University Curated by ChEMBL | Assay Description Inhibitory concentration against Glycogen synthase kinase-3 | Bioorg Med Chem Lett 15: 395-9 (2005) Article DOI: 10.1016/j.bmcl.2004.10.060 BindingDB Entry DOI: 10.7270/Q2WH2SR0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Glycogen synthase kinase-3 beta (Rattus norvegicus (rat)) | BDBM7364 (6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 38 |...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 920 | n/a | n/a | n/a | n/a | n/a | 30 |
Faculte de Medecine et de Pharmacie | Assay Description Kinase activities were assayed in buffers containing substrate, enzyme, and inhibitor at 30 °C in the presence of 15 uM ATP/ [gamma-32P] ATP. 32... | J Med Chem 46: 222-36 (2003) Article DOI: 10.1021/jm020319p BindingDB Entry DOI: 10.7270/Q2474820 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cyclin-dependent kinase 5 activator 1 [99-307] (Homo sapiens (Human)) | BDBM7364 (6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 38 |...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | 30 |
Faculte de Medecine et de Pharmacie | Assay Description Kinase activities were assayed in buffers containing substrate, enzyme, and inhibitor at 30 °C in the presence of 15 uM ATP/ [gamma-32P] ATP. 32... | J Med Chem 46: 222-36 (2003) Article DOI: 10.1021/jm020319p BindingDB Entry DOI: 10.7270/Q2474820 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cyclin-dependent kinase 1/G2/mitotic-specific cyclin-B (Marthasterias glacialis (starfish)) | BDBM7364 (6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 38 |...) | UniProtKB/SwissProt GoogleScholar AffyNet | Purchase MCE PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a | 30 |
Faculte de Medecine et de Pharmacie | Assay Description Kinase activities were assayed in buffers containing substrate, enzyme, and inhibitor at 30 °C in the presence of 15 uM ATP/ [gamma-32P] ATP. 32... | J Med Chem 46: 222-36 (2003) Article DOI: 10.1021/jm020319p BindingDB Entry DOI: 10.7270/Q2474820 | |||||||||||
More data for this Ligand-Target Pair |