Vinblastine

Vinblastine

SCHEMBL4707820

CC[C@]1(O)C[C@@H]2C[N@@](CCc3c([nH]c4ccccc34)[C@@](C(=O)OC)(c3cc4c(cc3OC)N(C)[C@H]3[C@@](O)(C(=O)OC)[C@H](OC(C)=O)[C@]5(CC)C=CCN6CC[C@]43[C@@H]65)C2)C1.CC[C@]1(O)C[C@@H]2C[N@@](CCc3c([nH]c4ccccc34)[C@@](C(=O)OC)(c3cc4c(cc3OC)N(C)[C@H]3[C@@](O)(C(=O)OC)[C@H](OC(C)=O)[C@]5(CC)C=CCN6CC[C@]43[C@@H]65)C2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8

The experimentally established mechanism targets of Vinblastine. 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
▸ TUBB4A known ✓ P04350 6/20 1.00
▸ TUBB known ✓ P07437 6/20 1.00
▸ TUBA3C known ✓ P0DPH7 6/20 1.00
▸ TUBA1B known ✓ P68363 6/20 1.00
▸ TUBA4A known ✓ P68366 6/20 1.00
▸ TUBB4B known ✓ P68371 6/20 1.00
▸ TUBB3 known ✓ Q13509 6/20 1.00
▸ TUBB2A known ✓ Q13885 6/20 1.00
▸ TUBB8 known ✓ Q3ZCM7 6/20 1.00
▸ TUBA3E known ✓ Q6PEY2 6/20 1.00
▸ TUBA1A known ✓ Q71U36 6/20 1.00
▸ TUBA1C known ✓ Q9BQE3 6/20 1.00
▸ TUBB6 known ✓ Q9BUF5 6/20 1.00
▸ TUBB2B known ✓ Q9BVA1 6/20 1.00
▸ TUBB1 known ✓ Q9H4B7 6/20 1.00
▸ MAPT P10636 8/20 1.00
▸ MEN1 O00255 7/20 1.00
▸ KMT2A Q03164 7/20 1.00
▸ LMNA P02545 6/20 1.00
▸ CYP3A4 P08684 6/20 1.00

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
Vinblastine SCHEMBL13300979 1.00 MAPT (1.00) MAPTMEN1KMT2ATUBB4ATUBB
Vinblastine SCHEMBL14601228 1.00 MAPT (1.00) MAPTMEN1KMT2ATUBB4ATUBB
Vinblastine SCHEMBL15866631 1.00 MAPT (1.00) MAPTMEN1KMT2ATUBB4ATUBB
Vinblastine SCHEMBL18613184 1.00 MAPT (1.00) MAPTMEN1KMT2ATUBB4ATUBB
Vinblastine SCHEMBL14445014 1.00 MAPT (1.00) MAPTMEN1KMT2ATUBB4ATUBB
Vinblastine SCHEMBL13279561 1.00 MAPT (1.00) MAPTMEN1KMT2ATUBB4ATUBB
Vinblastine SCHEMBL14077137 1.00 MAPT (1.00) MAPTMEN1KMT2ATUBB4ATUBB
Vinblastine SCHEMBL22450052 1.00 MAPT (1.00) MAPTMEN1KMT2ATUBB4ATUBB
Vinblastine SCHEMBL22022258 1.00 MAPT (1.00) MAPTMEN1KMT2ATUBB4ATUBB
Vinblastine SCHEMBL13529124 1.00 MAPT (1.00) MAPTMEN1KMT2ATUBB4ATUBB

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021083310-A1 ANTI-CANCER COMPOUNDS ACTING AS NON-PGP SUBSTRATE 深圳艾欣达伟医药科技有限公司 2021-05-06 — — WO claimed
CN-100490850-C Application of magnolia vine fruit in preparation of anti-tumor medicine or multi-medicine tolerant reversal agent HU XUN NINGBO YINGNUO PHARMACE (CN) 2009-05-27 — — CN claimed
CN-1833636-A Application of biphenyl cyclooctadiene lignin in treatment of tumour medicine HU XUN (CN) 2006-09-20 — — CN claimed
CN-1762450-A Application of magnolia vine fruit in preparation of anti-tumor medicine or multi-medicine tolerant reversal agent HU XUN (CN) 2006-04-26 — — CN claimed
CN-1236758-C Slow-releasing injection contg. hydrocastor oil/medicine (for treatment) solid dispersion microparticle WANG YUWAN (CN) 2006-01-18 — — CN claimed
CN-1461639-A Slow-releasing injection contg. hydrocastor oil/medicine (for treatment) solid dispersion microparticle WANG YUWAN (CN) 2003-12-17 — — CN claimed
EP-3675838-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS Puretecch LYT, Inc. (US) 2020-07-08 — — EP disclosed
WO-2019046491-A1 LYMPHATIC SYSTEM-DIRECTING LIPID PRODRUGS ARIYA THERAPEUTICS, INC. (US) 2019-03-07 — — WO disclosed
CN-102713618-B Protein Kinase Complexes and Inhibitors CELGENE AVILOMICS RES INC 2015-07-15 — — CN disclosed
EP-2776387-A1 TRICYCLIC AMINO CONTAINING COMPOUNDS FOR TREATMENT OR PREVENTION OF SYMPTOMS ASSOCIATED WITH ENDOCRINE DYSFUNCTION Emory University (US) 2014-09-17 — — EP disclosed
WO-2013078392-A1 METHODS AND COMPOSITIONS INVOLVING INDUCED SENESCENT CELLS FOR CANCER TREATMENT THE UNIVERSITY OF CHICAGO (US) 2013-05-30 — — WO disclosed
WO-2013070660-A1 TRICYCLIC AMINO CONTAINING COMPOUNDS FOR TREATMENT OR PREVENTION OF SYMPTOMS ASSOCIATED WITH ENDOCRINE DYSFUNCTION EMORY UNIVERSITY (US) 2013-05-16 — — WO disclosed
US-20130023897-A1 Devices and Methods for Endovascular Therapies CARDIOPROLIFIC INC. 2013-01-24 — — US disclosed
WO-2005032492-A2 SITE AND RATE SELECTIVE PRODRUG FORMULATIONS OF D609 WITH ANTIOXIDANT AND ANTICANCER ACTIVITY MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2005-04-14 — — WO disclosed
WO-2004055175-A1 METHOD FOR SELECTION OF COMPOUNDS WHICH INHIBIT CLONAL CELL GROWTH AND USE THEREOF TJOETTA ENOK (NO) 2004-07-01 — — WO disclosed
EP-1390075-A2 CHEMOTHERAPEUTIC INDUCTION OF EGR-1 PROMOTER ACTIVITY The University of Chicago (US) 2004-02-25 — — EP disclosed
CN-1461639-A Slow-releasing injection contg. hydrocastor oil/medicine (for treatment) solid dispersion microparticle WANG YUWAN (CN) 2003-12-17 — — CN disclosed
WO-2002080849-A2 CHEMOTHERAPEUTIC INDUCTION OF EGR-1 PROMOTER ACTIVITY UNIVERSITY OF CHICAGO (US) 2002-10-17 — — WO disclosed
US-5859013-A ADMINISTERING TO TREAT MULTIDRUG RESISTANT CANCERS HITACHI CHEMICAL CO., LTD. (JP) 1999-01-12 — — US disclosed
US-5733911-A ANTITUMOR AGENTS AND ANTICARCINOGENIC AGENTS HITACHI CHEMICAL CO., LTD. (JP) 1998-03-31 — — US disclosed
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