Paclitaxel

Paclitaxel

SCHEMBL3976

CC(=O)O[C@H]1C(=O)[C@@]2(C)[C@H]([C@H](OC(=O)c3ccccc3)[C@]3(O)C[C@H](OC(=O)[C@H](O)[C@@H](NC(=O)c4ccccc4)c4ccccc4)C(C)=C1C3(C)C)[C@]1(OC(C)=O)CO[C@@H]1C[C@@H]2O

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 Paclitaxel. 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 3/20 1.00
TUBB known ✓ P07437 3/20 1.00
TUBA3C known ✓ P0DPH7 3/20 1.00
TUBA1B known ✓ P68363 3/20 1.00
TUBA4A known ✓ P68366 3/20 1.00
TUBB4B known ✓ P68371 3/20 1.00
TUBB3 known ✓ Q13509 3/20 1.00
TUBB2A known ✓ Q13885 3/20 1.00
TUBB8 known ✓ Q3ZCM7 3/20 1.00
TUBA3E known ✓ Q6PEY2 3/20 1.00
TUBA1A known ✓ Q71U36 3/20 1.00
TUBA1C known ✓ Q9BQE3 3/20 1.00
TUBB6 known ✓ Q9BUF5 3/20 1.00
TUBB2B known ✓ Q9BVA1 3/20 1.00
TUBB1 known ✓ Q9H4B7 3/20 1.00
NPC1 O15118 8/20 1.00
RAB9A P51151 7/20 1.00
USP2 O75604 2/20 1.00
HIF1A Q16665 2/20 1.00
MEN1 O00255 2/20 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
Paclitaxel SCHEMBL13622863 1.00 NPC1 (1.00) NPC1RAB9ATUBB4ATUBBTUBA3C
Paclitaxel SCHEMBL15590870 1.00 NPC1 (1.00) NPC1RAB9ATUBB4ATUBBTUBA3C
Paclitaxel SCHEMBL759366 1.00 NPC1 (1.00) NPC1RAB9ATUBB4ATUBBTUBA3C
Paclitaxel SCHEMBL12929005 1.00 NPC1 (1.00) NPC1RAB9ATUBB4ATUBBTUBA3C
Paclitaxel SCHEMBL23760447 1.00 NPC1 (1.00) NPC1RAB9ATUBB4ATUBBTUBA3C
Paclitaxel SCHEMBL18389589 1.00 NPC1 (1.00) NPC1RAB9ATUBB4ATUBBTUBA3C
Paclitaxel SCHEMBL23760443 1.00 NPC1 (1.00) NPC1RAB9ATUBB4ATUBBTUBA3C
Paclitaxel SCHEMBL10122072 1.00 NPC1 (1.00) NPC1RAB9ATUBB4ATUBBTUBA3C
Paclitaxel SCHEMBL13241436 1.00 NPC1 (1.00) NPC1RAB9ATUBB4ATUBBTUBA3C
Paclitaxel SCHEMBL22149786 1.00 NPC1 (1.00) NPC1RAB9ATUBB4ATUBBTUBA3C

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

Appears in 393486 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119191366-A Doped magnetic nano particle and preparation method and application thereof 中国科学院精密测量科学与技术创新研究院 2024-12-27 CN claimed
US-12173039-B1 TPL2 inhibiting agents, uses thereof, and detection of TPL2 WASHINGTON UNIVERSITY (US) 2024-12-24 US claimed
US-20240415982-A1 GENE THERAPY WITH THE GENES HOKD AND LDRB FOR CANCER TREATMENT SERVICIO ANDALUZ DE SALUD (ES) 2024-12-19 US claimed
EP-4475955-A1 TREATMENT OF CANCER Immutep S.A.S. (FR) 2024-12-18 EP claimed
EP-4475895-A1 LOCALLY ADMINISTERED COMPOSITIONS AND METHODS OF USE THEREOF Fairleigh Dickinson University (US) 2024-12-18 EP claimed
WO-2024250427-A1 VINCAMINE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF 西南大学 2024-12-12 WO claimed
US-20240408071-A1 NOVEL COMBINATION OF SEROTONIN RECEPTOR (5-HTR2B) ANTAGONIST AND AN IMMUNOMODULATOR AND CHEMOTHERAPEUTIC DRUGS FOR INHIBITION OF CANCER NATIONAL CENTRE FOR CELL SCIENCE (IN) 2024-12-12 US claimed
US-20240409655-A1 ANTI-OX40 ANTIBODIES AND METHODS OF USE BEIGENE, LTD. (KY) 2024-12-12 US claimed
US-20240408175-A1 BMP9 OR AN AGONIST THEREOF AND ITS USES RELATED TO REDUCING METASTASIS OF CANCER THE UAB RESEARCH FOUNDATION (US) 2024-12-12 US claimed
WO-2024254103-A1 TGFB2-IRF5 THERAPEUTICS FOR CANCER GMP BIOTECHNOLOGY LIMITED (CN) 2024-12-12 WO claimed
EP-0253738-B1 TAXOL DERIVATIVES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM RHONE-POULENC SANTE (FR) 1990-01-31 EP claimed
EP-0336840-A1 Process for the preparation of taxol CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 1989-10-11 EP claimed
EP-0253739-B1 PROCESS FOR THE PREPARATION OF TAXOL AND OF DESACETYL-10-TAXOL RHONE-POULENC SANTE (FR) 1989-10-11 EP claimed
WO-1989008453-A1 NEW, WATER SOLUBLE, ANTINEOPLASTIC DERIVATIVES OF TAXOL THE UNITED STATES OF AMERICA, AS REPRESENTED BY TH (US) 1989-09-21 WO claimed
US-4857653-A Process for the preparation of taxol and 10-deacetyltaxol RHONE-POULENC SANTE (FR) 1989-08-15 US claimed
US-4814470-A Taxol derivatives, their preparation and pharmaceutical compositions containing them RHONE-POULENC SANTE (FR) 1989-03-21 US claimed
EP-0253738-A1 Taxol derivatives, their preparation and pharmaceutical compositions containing them RHONE-POULENC SANTE (FR) 1988-01-20 EP claimed
EP-0253739-A1 Process for the preparation of taxol and of desacetyl-10-taxol RHONE-POULENC SANTE (FR) 1988-01-20 EP claimed
WO-1986003007-A1 ASSAY FOR THE DETECTION OF EPIGENETIC TOXIC SUBSTANCES CHOU IIH NAN 1986-05-22 WO claimed
EP-0174810-A2 Multidrug resistance in mammalian cell lines and isolation of determinant glycoprotein DNA HSC Research Development Corporation (CA) 1986-03-19 EP claimed