DELANZOMIB

Search structure
Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 6IF28942WO

Structure
InChI Key SJFBTAPEPRWNKH-CCKFTAQKSA-N
Smile CC(C)C[C@H](NC(=O)[C@@H](NC(=O)c1cccc(-c2ccccc2)n1)[C@@H](C)O)B(O)O
InChI
InChI=1S/C21H28BN3O5/c1-13(2)12-18(22(29)30)24-21(28)19(14(3)26)25-20(27)17-11-7-10-16(23-17)15-8-5-4-6-9-15/h4-11,13-14,18-19,26,29-30H,12H2,1-3H3,(H,24,28)(H,25,27)/t14-,18+,19+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H28BN3O5
Molecular Weight 413.28
AlogP None
Hydrogen Bond Acceptor None
Hydrogen Bond Donor None
Number of Rotational Bond None
Polar Surface Area None
Molecular species None
Aromatic Rings None
Heavy Atoms None

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Cytochrome P450 Cytochrome P450 family 3 Cytochrome P450 family 3A Cytochrome P450 3A4
- 3500 - - -
Enzyme Protease Aspartic protease Aspartic protease AA clan Aspartic protease A1A subfamily
- - - - 1
Enzyme Protease Cysteine protease Cysteine protease CA clan Cysteine protease C1A family
- - - - 12
Enzyme Protease Cysteine protease Cysteine protease CA clan Cysteine protease C2 family
- - - - 0
Enzyme Protease Cysteine protease Cysteine protease CD clan Cysteine protease C14 family
- - - - 0
Enzyme Protease Cysteine protease Cysteine protease PAC clan Cysteine protease C3A subfamily
- - - - 1
Enzyme Protease Metallo protease Metallo protease MAE clan Metallo protease M13 family
- - - - 12
Enzyme Protease Metallo protease Metallo protease MAM clan Metallo protease M10A subfamily
- - - -
Enzyme Protease Metallo protease Metallo protease MAM clan Metallo protease M12B subfamily
- - - - 1
Enzyme Protease Serine protease Serine protease PA clan Serine protease S1A subfamily
14 14-2110 - - 0
Enzyme Protease Serine protease Serine protease SC clan Serine protease S9B subfamily
- - - -
Enzyme Protease Threonine protease Threonine protease PBT clan Threonine protease T1A subfamily
- 3-4 - - -
Enzyme Protease Threonine protease Threonine protease PBT clan Threonine protease T1B subfamily
- 1 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Multiple Myeloma 1 D009101 ClinicalTrials
Lymphoma, Non-Hodgkin 1 D008228 ClinicalTrials

Cross References

Resources Reference
ChEBI 141530
ChEMBL CHEMBL270515
DrugBank DB11956
FDA SRS 6IF28942WO
PubChem 24800541
SureChEMBL SCHEMBL555047
ZINC ZINC000169748228
CONTENTS