Molecule Details
| InChIKey | BLMPQMFVWMYDKT-NZTKNTHTSA-N |
|---|---|
| Compound Name | Carfilzomib |
| Canonical SMILES | CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)NC(=O)CN1CCOCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)[C@@]1(C)CO1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 43 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.82 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB08889 |
|---|---|
| Drug Name | Carfilzomib |
| CAS Number | 868540-17-4 |
| Groups | approved investigational |
| ATC Codes | L01XG02 |
| Description | Carfilzomib is an injectable antineoplastic agent (IV only). Chemically, it is a modified tetrapeptidyl epoxide and an analog of epoxomicin. It is also a selective proteasome inhibitor. FDA approved carfilzomib in July 2012 for the treatment of adults with relapsed or refractory multiple myeloma as ... |
Categories: Amino Acids, Peptides, and Proteins Antineoplastic Agents Antineoplastic and Immunomodulating Agents Immunosuppressive Agents Myelosuppressive Agents Narrow Therapeutic Index Drugs P-glycoprotein inhibitors P-glycoprotein substrates P-glycoprotein substrates with a Narrow Therapeutic Index Peptides Proteasome Inhibitors
Cross-references: BindingDB: 50277889 ChEBI: 65347 CHEMBL451887 ChemSpider: 9731489 Drugs Product Database (DPD): 22678 D08880 PharmGKB: PA166165203 PubChem:11556711 PubChem:175427135 RxCUI: 1302966 Wikipedia: Carfilzomib ZINC: ZINC000049841054
Target Activities (43)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P28074 | PSMB5 | Homo sapiens | Human | PF00227 | 8.1 | IC50 | ChEMBL;BindingDB |
| A5LHX3 | PSMB11 | Homo sapiens | Human | PF00227 | 8.1 | IC50 | ChEMBL |
| O00231 | PSMD11 | Homo sapiens | Human | PF01399 PF18503 PF18055 | 8.1 | IC50 | ChEMBL |
| O00232 | PSMD12 | Homo sapiens | Human | PF01399 PF22241 PF18098 | 8.1 | IC50 | ChEMBL |
| O00487 | PSMD14 | Homo sapiens | Human | PF01398 PF23594 | 8.1 | IC50 | ChEMBL |
| O14818 | PSMA7 | Homo sapiens | Human | PF00227 PF10584 | 8.1 | IC50 | ChEMBL |
| O43242 | PSMD3 | Homo sapiens | Human | PF01399 PF08375 PF25573 | 8.1 | IC50 | ChEMBL |
| P17980 | PSMC3 | Homo sapiens | Human | PF00004 PF17862 PF16450 | 8.1 | IC50 | ChEMBL |
| P20618 | PSMB1 | Homo sapiens | Human | PF00227 | 8.1 | IC50 | ChEMBL |
| P25786 | PSMA1 | Homo sapiens | Human | PF00227 PF10584 | 8.1 | IC50 | ChEMBL |
| P25787 | PSMA2 | Homo sapiens | Human | PF00227 PF10584 | 8.1 | IC50 | ChEMBL |
| P25788 | PSMA3 | Homo sapiens | Human | PF00227 PF10584 | 8.1 | IC50 | ChEMBL |
| P25789 | PSMA4 | Homo sapiens | Human | PF00227 PF10584 | 8.1 | IC50 | ChEMBL |
| P28066 | PSMA5 | Homo sapiens | Human | PF00227 PF10584 | 8.1 | IC50 | ChEMBL |
| P28070 | PSMB4 | Homo sapiens | Human | PF00227 | 8.1 | IC50 | ChEMBL |
| P35998 | PSMC2 | Homo sapiens | Human | PF00004 PF17862 PF21236 | 8.1 | IC50 | ChEMBL |
| P43686 | PSMC4 | Homo sapiens | Human | PF00004 PF17862 PF16450 | 8.1 | IC50 | ChEMBL |
| P48556 | PSMD8 | Homo sapiens | Human | PF10075 | 8.1 | IC50 | ChEMBL |
| P49720 | PSMB3 | Homo sapiens | Human | PF00227 | 8.1 | IC50 | ChEMBL |
| P51665 | PSMD7 | Homo sapiens | Human | PF01398 PF13012 | 8.1 | IC50 | ChEMBL |
| P55036 | PSMD4 | Homo sapiens | Human | PF02809 PF13519 | 8.1 | IC50 | ChEMBL |
| P60896 | SEM1 | Homo sapiens | Human | PF05160 | 8.1 | IC50 | ChEMBL |
| P60900 | PSMA6 | Homo sapiens | Human | PF00227 PF10584 | 8.1 | IC50 | ChEMBL |
| P62191 | PSMC1 | Homo sapiens | Human | PF00004 PF17862 PF16450 | 8.1 | IC50 | ChEMBL |
| P62195 | PSMC5 | Homo sapiens | Human | PF00004 PF17862 PF16450 | 8.1 | IC50 | ChEMBL |
| P62333 | PSMC6 | Homo sapiens | Human | PF00004 PF17862 PF16450 | 8.1 | IC50 | ChEMBL |
| Q13200 | PSMD2 | Homo sapiens | Human | PF01851 PF18051 PF17781 | 8.1 | IC50 | ChEMBL |
| Q15008 | PSMD6 | Homo sapiens | Human | PF01399 PF10602 PF21154 | 8.1 | IC50 | ChEMBL |
| Q16186 | ADRM1 | Homo sapiens | Human | PF04683 PF16550 | 8.1 | IC50 | ChEMBL |
| Q8TAA3 | PSMA8 | Homo sapiens | Human | PF00227 PF10584 | 8.1 | IC50 | ChEMBL |
| Q99436 | PSMB7 | Homo sapiens | Human | PF12465 PF00227 | 8.1 | IC50 | ChEMBL;BindingDB |
| Q99460 | PSMD1 | Homo sapiens | Human | PF13646 PF01851 PF18004 PF21505 | 8.1 | IC50 | ChEMBL |
| Q9UNM6 | PSMD13 | Homo sapiens | Human | PF01399 PF22037 | 8.1 | IC50 | ChEMBL |
| P28065 | PSMB9 | Homo sapiens | Human | PF00227 | 7.9 | IC50 | ChEMBL |
| P28072 | PSMB6 | Homo sapiens | Human | PF00227 | 7.9 | IC50 | ChEMBL |
| P40306 | PSMB10 | Homo sapiens | Human | PF12465 PF00227 | 7.8 | IC50 | ChEMBL;BindingDB |
| P28062 | PSMB8 | Homo sapiens | Human | PF00227 | 7.6 | IC50 | ChEMBL;BindingDB |
| P78417 | GSTO1 | Homo sapiens | Human | PF14497 PF13409 | 6.8 | IC50 | ChEMBL;BindingDB |
| P49721 | PSMB2 | Homo sapiens | Human | PF00227 | 6.7 | IC50 | ChEMBL;BindingDB |
| P08684 | CYP3A4 | Homo sapiens | Human | PF00067 | 6.3 | IC50 | ChEMBL |
| P20815 | CYP3A5 | Homo sapiens | Human | PF00067 | 6.3 | IC50 | ChEMBL |
| P24462 | CYP3A7 | Homo sapiens | Human | PF00067 | 6.3 | IC50 | ChEMBL |
| Q9HB55 | CYP3A43 | Homo sapiens | Human | PF00067 | 6.3 | IC50 | ChEMBL |
DrugBank Target Actions (8)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P20618 | PSMB1 | Proteasome subunit beta type-1 | inhibitor | targets |
| P28062 | PSMB8 | Proteasome subunit beta type-8 | inhibitor | targets |
| P28065 | PSMB9 | Proteasome subunit beta type-9 | inhibitor | targets |
| P28074 | PSMB5 | Proteasome subunit beta type-5 | inhibitor | targets |
| P40306 | PSMB10 | Proteasome subunit beta type-10 | inhibitor | targets |
| P49721 | PSMB2 | Proteasome subunit beta type-2 | inhibitor | targets |
| P08183 | ABCB1 | ATP-dependent translocase ABCB1 | inhibitor | transporters |
| P08183 | ABCB1 | ATP-dependent translocase ABCB1 | substrate | transporters |