Structure

InChI Key MXAYKZJJDUDWDS-LBPRGKRZSA-N
Smiles CC(C)C[C@H](NC(=O)CNC(=O)c1cc(Cl)ccc1Cl)B(O)O
InChI
InChI=1S/C14H19BCl2N2O4/c1-8(2)5-12(15(22)23)19-13(20)7-18-14(21)10-6-9(16)3-4-11(10)17/h3-4,6,8,12,22-23H,5,7H2,1-2H3,(H,18,21)(H,19,20)/t12-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H19BCl2N2O4
Molecular Weight 361.03

Pharmacology

Mechanism of Action Action Reference
26S proteasome inhibitor INHIBITOR EMA PubMed PubMed
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
- 3-65.5 - - -

Target Conservation

Protein: 26S proteasome

Description: Proteasome subunit beta type-11

Organism : Homo sapiens

A5LHX3 ENSG00000222028
Protein: 26S proteasome

Description: 26S proteasome non-ATPase regulatory subunit 11

Organism : Homo sapiens

O00231 ENSG00000108671
Protein: 26S proteasome

Description: 26S proteasome non-ATPase regulatory subunit 12

Organism : Homo sapiens

O00232 ENSG00000197170
Protein: 26S proteasome

Description: Proteasome subunit alpha type-7

Organism : Homo sapiens

O14818 ENSG00000101182
Protein: 26S proteasome

Description: 26S proteasome non-ATPase regulatory subunit 3

Organism : Homo sapiens

O43242 ENSG00000108344
Protein: 26S proteasome

Description: 26S proteasome regulatory subunit 6A

Organism : Homo sapiens

P17980 ENSG00000165916
Protein: 26S proteasome

Description: Proteasome subunit beta type-1

Organism : Homo sapiens

P20618 ENSG00000008018
Protein: 26S proteasome

Description: Proteasome subunit alpha type-1

Organism : Homo sapiens

P25786 ENSG00000129084
Protein: 26S proteasome

Description: Proteasome subunit alpha type-2

Organism : Homo sapiens

P25787 ENSG00000106588
Protein: 26S proteasome

Description: Proteasome subunit alpha type-3

Organism : Homo sapiens

P25788 ENSG00000100567
Protein: 26S proteasome

Description: Proteasome subunit alpha type-4

Organism : Homo sapiens

P25789 ENSG00000041357
Protein: 26S proteasome

Description: Proteasome subunit beta type-8

Organism : Homo sapiens

P28062 ENSG00000204264
Protein: 26S proteasome

Description: Proteasome subunit beta type-9

Organism : Homo sapiens

P28065 ENSG00000240065
Protein: 26S proteasome

Description: Proteasome subunit alpha type-5

Organism : Homo sapiens

P28066 ENSG00000143106
Protein: 26S proteasome

Description: Proteasome subunit beta type-4

Organism : Homo sapiens

P28070 ENSG00000159377
Protein: 26S proteasome

Description: Proteasome subunit beta type-6

Organism : Homo sapiens

P28072 ENSG00000142507
Protein: 26S proteasome

Description: Proteasome subunit beta type-5

Organism : Homo sapiens

P28074 ENSG00000100804
Protein: 26S proteasome

Description: 26S proteasome regulatory subunit 7

Organism : Homo sapiens

P35998 ENSG00000161057
Protein: 26S proteasome

Description: Proteasome subunit beta type-10

Organism : Homo sapiens

P40306 ENSG00000205220
Protein: 26S proteasome

Description: 26S proteasome regulatory subunit 6B

Organism : Homo sapiens

P43686 ENSG00000013275
Protein: 26S proteasome

Description: 26S proteasome non-ATPase regulatory subunit 8

Organism : Homo sapiens

P48556 ENSG00000099341
Protein: 26S proteasome

Description: Proteasome subunit beta type-3

Organism : Homo sapiens

P49720 ENSG00000277791
Protein: 26S proteasome

Description: Proteasome subunit beta type-2

Organism : Homo sapiens

P49721 ENSG00000126067
Protein: 26S proteasome

Description: 26S proteasome non-ATPase regulatory subunit 7

Organism : Homo sapiens

P51665 ENSG00000103035
Protein: 26S proteasome

Description: 26S proteasome complex subunit SEM1

Organism : Homo sapiens

P60896 ENSG00000127922
Protein: 26S proteasome

Description: Proteasome subunit alpha type-6

Organism : Homo sapiens

P60900 ENSG00000100902
Protein: 26S proteasome

Description: 26S proteasome regulatory subunit 4

Organism : Homo sapiens

P62191 ENSG00000100764
Protein: 26S proteasome

Description: 26S proteasome regulatory subunit 8

Organism : Homo sapiens

P62195 ENSG00000087191
Protein: 26S proteasome

Description: 26S proteasome regulatory subunit 10B

Organism : Homo sapiens

P62333 ENSG00000100519
Protein: 26S proteasome

Description: 26S proteasome non-ATPase regulatory subunit 2

Organism : Homo sapiens

Q13200 ENSG00000175166
Protein: 26S proteasome

Description: 26S proteasome non-ATPase regulatory subunit 6

Organism : Homo sapiens

Q15008 ENSG00000163636
Protein: 26S proteasome

Description: Proteasomal ubiquitin receptor ADRM1

Organism : Homo sapiens

Q16186 ENSG00000130706
Protein: 26S proteasome

Description: Proteasome subunit alpha-type 8

Organism : Homo sapiens

Q8TAA3 ENSG00000154611
Protein: 26S proteasome

Description: Proteasome subunit beta type-7

Organism : Homo sapiens

Q99436 ENSG00000136930
Protein: 26S proteasome

Description: 26S proteasome non-ATPase regulatory subunit 1

Organism : Homo sapiens

Q99460 ENSG00000173692
Protein: 26S proteasome

Description: 26S proteasome non-ATPase regulatory subunit 13

Organism : Homo sapiens

Q9UNM6 ENSG00000185627

Cross References

Resources Reference
ChEBI 90942
ChEMBL CHEMBL2141296
DrugBank DB09570
DrugCentral 5067
FDA SRS 71050168A2
Guide to Pharmacology 8450
PDB 6V8
PubChem 25183872
SureChEMBL SCHEMBL3742758
ZINC ZINC000169946773