Stavudine

Stavudine

SCHEMBL4773402

Cc1cn([C@H]2C=C[C@@H](CO)O2)c(=O)[nH]c1=O.Nc1ccn([C@H]2CS[C@@H](CO)O2)c(=O)n1

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

pol

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

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALB P02768 4/20 0.64
LMNA P02545 3/20 0.64
CACNA1F O60840 2/20 0.64
MAPT P10636 2/20 0.64
CACNA1D Q01668 2/20 0.64
CACNA1S Q13698 2/20 0.64
CACNA1C Q13936 2/20 0.64
PDE3A Q14432 2/20 0.64
ALDH1A1 P00352 1/20 0.57
POLB P06746 1/20 0.57
ADRA1A P35348 1/20 0.57
BLM P54132 1/20 0.57
POLG P54098 1/20 0.45
BCHE P06276 8/20 0.39
TK2 O00142 1/20 0.39
TK1 P04183 2/20 0.38

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
Stavudine SCHEMBL28086387 1.00 ALB (0.64) ALBLMNACACNA1FMAPTCACNA1D
Didanosine SCHEMBL23925471 0.86 ALB (0.50) ALBLMNACACNA1FMAPTCACNA1D
Stavudine SCHEMBL4405002 0.86 ALB (0.66) ALBLMNACACNA1FMAPTCACNA1D
Lamivudine SCHEMBL22364335 0.86 ALB (0.65) ALBLMNACACNA1FMAPTCACNA1D
Stavudine SCHEMBL7053412 0.86 LMNA (0.60) ALBLMNACACNA1FMAPTCACNA1D
Stavudine SCHEMBL8185422 0.86 LMNA (0.60) ALBLMNACACNA1FMAPTCACNA1D
Nevirapine SCHEMBL1898785 0.83 LMNA (0.46) ALBLMNACACNA1FMAPTCACNA1D
Nevirapine SCHEMBL29379693 0.83 LMNA (0.46) ALBLMNACACNA1FMAPTCACNA1D
Lamivudine SCHEMBL465678 0.80 ALB (1.00) ALBLMNACACNA1FMAPTCACNA1D
Lamivudine SCHEMBL2422788 0.80 ALB (1.00) ALBLMNACACNA1FMAPTCACNA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101768152-A Piperidine derivatives useful as CCR5 antagonists SCHERING CORP 2010-07-07 CN disclosed
CN-100591678-C Piperidine derivatives as CCR5 antagonists SCHERING CORP 2010-02-24 CN disclosed
CN-100490811-C Piperazine derivative used as CCRS antagonist SCHLING (US) 2009-05-27 CN disclosed
CN-101426781-A CCR5 antagonists useful for treating HIV SCHERING CORP (US) 2009-05-06 CN disclosed
EP-1933823-A1 PHARMACEUTICAL COMPOSITION ON BASIS OF REVERSE TRANSCRIPTASE INHIBITOR AND MELDONIUM "Grindeks" Public Joint Stock Company (LV) 2008-06-25 EP disclosed
EP-1912671-A2 BETA-GLUCURONIDE-LINKER DRUG CONJUGATES Seattle Genetics, Inc. (US) 2008-04-23 EP disclosed
CN-101163695-A Piperidinylpiperazine derivatives as chemokine receptor inhibitors SCHERING CORP (US) 2008-04-16 CN disclosed
CN-101133050-A Piperidinyl piperidines as chemokine receptor inhibitors SCHERING CORP (US) 2008-02-27 CN disclosed
CN-1304389-C Piperidine derivatives useful as CCR5 antagonists SCHERING CORP (US) 2007-03-14 CN disclosed
WO-2007021164-A1 PHARMACEUTICAL COMPOSITION ON BASIS OF REVERSE TRANSCRIPTASE INHIBITOR AND MELDONIUM LATVIAN INSTITUE OF ORGANIC SYNTHESIS (LV) 2007-02-22 WO disclosed
US-20040106606-A1 HIV protease inhibitors BOYER FREDERICK EARL (US) 2004-06-03 US disclosed
CN-1500078-A Aryl oxime-piperazines useful as CCR5 antagonists ���鹫˾ 2004-05-26 CN disclosed
CN-1151131-C Piperidine derivatives as CCR5 antagonists ���鹫˾ 2004-05-26 CN disclosed
CN-1481251-A Combination methods for treating viral infections ���鹫˾ 2004-03-10 CN disclosed
CN-1450992-A piperazine derivatives useful as CCR5 antagonists SCHERING CORP (US) 2003-10-22 CN disclosed
US-6528510-B1 Dihydropyrones with tethered heterocycles; 3-(2-tert-Butyl-4-hydroxymethyl-5-methyl-phenylsulfanyl)-4-hydroxy-6 -isopropyl-6-(2-pyridin-4-yl-ethyl)-5,6-dihydro-pyran - 2-one; WARNER-LAMBERT COMPANY 2003-03-04 US disclosed
CN-1349504-A Piperidine derivatives as CCR5 antagonists SCHERING CORP (US) 2002-05-15 CN disclosed
CN-1349408-A Pegylated interferon alfa-CCR5 antagonist combination HIV therapy SCHERING CORP (US) 2002-05-15 CN disclosed
EP-1112269-A2 HIV PROTEASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2001-07-04 EP disclosed
WO-2000015634-A2 HIV PROTEASE INHIBITORS WARNER-LAMBERT COMPANY (US) 2000-03-23 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040106606-A1 HIV protease inhibitors DNPEP, PREP, PEPD ALB 4309/4885LMNA 3098/4885CACNA1F 4574/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.