Bortezomib

Bortezomib

SCHEMBL28091384

CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O.O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnccn1

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRM1PSMA1PSMA2PSMA3PSMA4PSMA5PSMA6PSMA7PSMA8PSMB1PSMB10PSMB11PSMB2PSMB3PSMB4PSMB5PSMB6PSMB7PSMB8PSMB9PSMC1PSMC2PSMC3PSMC4PSMC5PSMC6PSMD1PSMD11PSMD12PSMD13PSMD14PSMD2PSMD3PSMD4PSMD6PSMD7PSMD8SEM1

The experimentally established mechanism targets of Bortezomib. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 known ✓ P28074 16/20 0.94
▸ PSMB8 known ✓ P28062 8/20 0.94
▸ PSMB9 known ✓ P28065 8/20 0.94
▸ PSMB6 known ✓ P28072 8/20 0.94
▸ PSMB10 known ✓ P40306 8/20 0.94
▸ PSMB11 known ✓ A5LHX3 7/20 0.94
▸ PSMA7 known ✓ O14818 7/20 0.94
▸ PSMB1 known ✓ P20618 7/20 0.94
▸ PSMA1 known ✓ P25786 7/20 0.94
▸ PSMA2 known ✓ P25787 7/20 0.94
▸ PSMA3 known ✓ P25788 7/20 0.94
▸ PSMA4 known ✓ P25789 7/20 0.94
▸ PSMA5 known ✓ P28066 7/20 0.94
▸ PSMB4 known ✓ P28070 7/20 0.94
▸ PSMB3 known ✓ P49720 7/20 0.94
▸ PSMB2 known ✓ P49721 7/20 0.94
▸ PSMA6 known ✓ P60900 7/20 0.94
▸ PSMA8 known ✓ Q8TAA3 7/20 0.94
▸ PSMB7 known ✓ Q99436 7/20 0.94
▸ PSMD11 known ✓ O00231 1/20 0.94

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Bortezomib SCHEMBL8036967 0.97 PSMB5 (1.00) PSMB5LONP1PSMB8PSMB9PSMB6
Bortezomib SCHEMBL685473 0.97 PSMB5 (1.00) PSMB5LONP1PSMB8PSMB9PSMB6
Bortezomib SCHEMBL30316729 0.97 PSMB5 (1.00) PSMB5LONP1PSMB8PSMB9PSMB6
Bortezomib SCHEMBL192129 0.97 PSMB5 (1.00) PSMB5LONP1PSMB8PSMB9PSMB6
Bortezomib SCHEMBL8099424 0.97 PSMB5 (1.00) PSMB5LONP1PSMB8PSMB9PSMB6
Bortezomib SCHEMBL3676 0.97 PSMB5 (1.00) PSMB5LONP1PSMB8PSMB9PSMB6
Bortezomib SCHEMBL8035134 0.97 PSMB5 (1.00) PSMB5LONP1PSMB8PSMB9PSMB6
Bortezomib SCHEMBL29377226 0.97 PSMB5 (1.00) PSMB5LONP1PSMB8PSMB9PSMB6
Bortezomib SCHEMBL8049740 0.97 PSMB5 (1.00) PSMB5LONP1PSMB8PSMB9PSMB6
Bortezomib SCHEMBL466239 0.97 PSMB5 (1.00) PSMB5LONP1PSMB8PSMB9PSMB6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105837608-A Proteasome inhibitor and composition and application thereof 米伦纽姆医药公司 2016-08-10 — — CN disclosed
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