Showing entry for Hymenialdisine


　 　 　 　 　 　 　 　 　 　 　 　 　 　 　
General Compound Information
BXGC IdBXGC0038970
Compound NameHymenialdisine
Structure
FormulaC11H10BrN5O2
InchiKeyATBAETXFFCOZOY-UHFFFAOYSA-N
SMILESN=C1N=C(C(=C2CCNC(=O)c3c2cc([nH]3)Br)N1)O
InchiInChI=1S/C11H10BrN5O2/c12-6-3-5-4(7-10(19)17-11(13)16-7)1-2-14-9(18)8(5)15-6/h3,15H,1-2H2,(H,14,18)(H3,13,16,17,19)
IUPAC4-(2-amino-4-oxo-1H-imidazol-5-ylidene)-2-bromo-1,5,6,7-tetrahydropyrrolo[2,3-c]azepin-8-one
Molecular Weight323
Pubchem Id135459971
Chembl Id
Targets of Information Source
DrugBank n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
Uniport Id BXGT Id Protein Name Status Protein Class Gene Groups Target Type
PDB n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM Ka M-1
Binding DB 7491
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
Uniport Id BXGT Id Protein Name Status Protein Class Gene Ki nM ic50 nM Kd nM EC50 nM
reviewed BXGT012534 Cyclin-dependent-like kinase 5 reviewed Kinase CDK5 - 28 - -
reviewed BXGT008394 Glycogen synthase kinase-3 beta reviewed Gsk3b - 10 - -
reviewed BXGT013534 Cyclin-dependent kinase 5 activator 1 reviewed Enzyme modulator CDK5R1 - 37 - -
reviewed BXGT006445 Cyclin-dependent kinase 1 reviewed Kinase CDK1 - 70 - -
reviewed BXGT010750 Glycogen synthase kinase-3 beta reviewed Kinase GSK3B - 73 - -
reviewed BXGT008294 Protein kinase C alpha type reviewed Kinase PRKCA - 700 - -
reviewed BXGT004092 Serine/threonine-protein kinase Chk1 reviewed Kinase CHEK1 - 1950 - -
reviewed BXGT004092 Serine/threonine-protein kinase Chk1 reviewed Kinase CHEK1 - 1900 - -
reviewed BXGT006384 Protein kinase C beta type reviewed Kinase PRKCB - 1200 - -
reviewed BXGT011599 Casein kinase II subunit alpha reviewed Kinase CSNK2A1 - 7000 - -
reviewed BXGT009263 Mitogen-activated protein kinase 1 reviewed Kinase MAPK1 - 6 - -
reviewed BXGT010656 Casein kinase I isoform delta reviewed Kinase CSNK1D - 35 - -
reviewed BXGT005415 Serine/threonine-protein kinase Chk2 reviewed Kinase CHEK2 - 42 - -
reviewed BXGT019947 Mitogen-activated protein kinase kinase kinase 5 reviewed Kinase MAP3K5 - 7000 - -
reviewed BXGT019947 Mitogen-activated protein kinase kinase kinase 5 reviewed Kinase MAP3K5 - 150 - -
reviewed BXGT010750 Glycogen synthase kinase-3 beta reviewed Kinase GSK3B - 10 - -
reviewed BXGT009263 Mitogen-activated protein kinase 1 reviewed Kinase MAPK1 - 6 - -
reviewed BXGT012662 Dual specificity mitogen-activated protein kinase kinase 1 reviewed Kinase MAP2K1 - 2500 - -
reviewed BXGT012662 Dual specificity mitogen-activated protein kinase kinase 1 reviewed Kinase MAP2K1 - 2500 - -
reviewed BXGT009263 Mitogen-activated protein kinase 1 reviewed Kinase MAPK1 - 9 - -
reviewed BXGT012662 Dual specificity mitogen-activated protein kinase kinase 1 reviewed Kinase MAP2K1 - 6 - -
reviewed BXGT006445 Cyclin-dependent kinase 1 reviewed Kinase CDK1 - 22 - -
CHEMBL n.a
Uniport Id BXGT Id Protein Name Status Protein Class Gene width="10%">Type Relation value Units
Uniport Id BXGT Id Protein Name Status Protein Class Gene Type Relation value Units
Foods  containing  the  compound
Foods
BXGF Id Food Name Scientific Name Food Group
BXGF Id Food Name Scientific Name Food Group
BXGF05755 Vernonia arctioides Vernonia arctioides Others
BXGF06051 Echinocystis fabacea Echinocystis fabacea Medicinal Plant
The  compound-realted  diseases
Diseases
BXGD Id Disease Name CUI Disease Id Disease Class Name Number of targets?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease