Nisoxetine

Nisoxetine

SCHEMBL14973458

CNCCC(Oc1ccccc1OC)c1ccccc1.[Cl-].[H+]

nearest known ligand 0.94

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Nisoxetine. 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
SLC6A2 known ✓ P23975 11/20 0.94
SLC6A3 known ✓ Q01959 3/20 0.94
CHRM1 known ✓ P11229 2/20 0.69
SLC6A4 P31645 12/20 0.94
CYP2D6 P10635 5/20 0.94
CYP1A2 P05177 4/20 0.94
CYP3A4 P08684 4/20 0.94
TSHR P16473 3/20 0.94
KMT2A Q03164 2/20 0.94
MEN1 O00255 1/20 0.94
CYP2C19 P33261 1/20 0.94
PMP22 Q01453 2/20 0.91
ADRA2B P18089 2/20 0.69
HTR2A P28223 2/20 0.69
HTR2C P28335 2/20 0.69
HRH1 P35367 2/20 0.69
OPRM1 P35372 2/20 0.69
DRD3 P35462 2/20 0.69
OPRK1 P41145 2/20 0.69
HTR2B P41595 2/20 0.69

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
Nisoxetine SCHEMBL3892886 0.97 SLC6A4 (1.00) SLC6A4SLC6A2CYP2D6CYP1A2CYP3A4
Nisoxetine SCHEMBL124289 0.97 SLC6A4 (1.00) SLC6A4SLC6A2CYP2D6CYP1A2CYP3A4
Nisoxetine SCHEMBL29401038 0.97 SLC6A4 (1.00) SLC6A4SLC6A2CYP2D6CYP1A2CYP3A4
Nisoxetine SCHEMBL30026153 0.97 SLC6A4 (1.00) SLC6A4SLC6A2CYP2D6CYP1A2CYP3A4
Nisoxetine SCHEMBL3897550 0.97 SLC6A4 (1.00) SLC6A4SLC6A2CYP2D6CYP1A2CYP3A4
Nisoxetine SCHEMBL467262 0.95 SLC6A2 (1.00) SLC6A4SLC6A2CYP2D6CYP1A2CYP3A4
Nisoxetine SCHEMBL29440249 0.95 SLC6A2 (1.00) SLC6A4SLC6A2CYP2D6CYP1A2CYP3A4
Nisoxetine SCHEMBL4083146 0.90 SLC6A4 (0.86) SLC6A4SLC6A2CYP2D6CYP1A2CYP3A4
[3H]Nisoxetine SCHEMBL29463855 0.87 SLC6A2 (1.00) SLC6A4SLC6A2CYP2D6CYP1A2CYP3A4
Atomoxetine SCHEMBL1648558 0.85 SLC6A4 (0.94) SLC6A4SLC6A2CYP2D6CYP1A2CYP3A4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2576778-B1 TRANSGENIC REPORTER SYSTEM THAT REVEALS EXPRESSION PROFILES AND REGULATION MECHANISMS OF ALTERNATIVE SPLICING IN RODENTS UNIV KYOTO (JP) 2017-08-09 EP disclosed
US-9273364-B2 Transgenic reporter system that reveals expression profiles and regulation mechanisms of alternative splicing in mammalian organisms KYOTO UNIVERSITY (JP) 2016-03-01 US disclosed
US-20140024677-A1 METHODS FOR INDUCING MITOCHONDRIAL BIOGENESIS MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2014-01-23 US disclosed
US-20130137099-A1 TRANSGENIC REPORTER SYSTEM THAT REVEALS EXPRESSION PROFILES AND REGULATION MECHANISMS OF ALTERNATIVE SPLICING IN MAMMALIAN ORGANISMS KYOTO UNIVERSITY (JP) 2013-05-30 US 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-20140024677-A1 METHODS FOR INDUCING MITOCHONDRIAL BIOGENESIS TFAM, TXNRD2, CPT1B SLC6A2 270/4885SLC6A3 563/4885CHRM1 3806/4885

“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.