Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.63 |
| ▸ | CCR3 | P51677 | 1/20 | 0.61 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.60 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.60 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.60 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.58 |
| ▸ | HTR2A | P28223 | 3/20 | 0.57 |
| ▸ | HTR2C | P28335 | 2/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.57 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27678283 | 0.98 | ACHE (0.61) | ACHECCR3HDAC1HDAC8HDAC6 | |
| SCHEMBL27940510 | 0.90 | ACHE (0.55) | ACHECCR3HDAC1HDAC8HDAC6 | |
| Hydrochloric Acid SCHEMBL9647473 | 0.89 | SIGMAR1 (0.62) | CCR3HTR2AKCNH2SIGMAR1CYP1A2 | |
| SCHEMBL3887187 | 0.85 | HRH3 (0.54) | ACHECCR3HDAC1HDAC8HDAC6 | |
| SCHEMBL4069868 | 0.84 | HTR2A (0.59) | HTR2AHTR2CKCNH2 | |
| SCHEMBL700085 | 0.83 | ACHE (0.61) | ACHECCR3HDAC8HTR2ASIGMAR1 | |
| SCHEMBL28532094 | 0.83 | ACHE (0.61) | ACHECCR3HDAC8HTR2ASIGMAR1 | |
| Hydrochloric Acid SCHEMBL8502542 | 0.83 | HTR2A (0.58) | HTR2AHTR2CKCNH2 | |
| SCHEMBL4255182 | 0.82 | ACHE (0.71) | ACHECCR3SLC6A3HTR2AHTR2C | |
| Methyl Alcohol SCHEMBL27735067 | 0.82 | HRH3 (0.51) | ACHEHDAC1HDAC8HDAC6HTR2A |
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 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102143953-A | Pyrimidines, triazines and their use as pharmaceutical agents | UNIV NOTTINGHAM | 2011-08-03 | — | — | CN | claimed |
| JP-2124885-A | — | — | None | — | — | JP | disclosed |
| CN-105111136-A | Method for preparing 3-mehtyl-1-phenethyl piperidine-4-ketone or 1-phenethyl piperidine-4-ketone | SHANGHAI HOBOR CHEMICAL CO LTD | 2015-12-02 | — | — | CN | disclosed |
| CN-105111136-A | Method for preparing 3-mehtyl-1-phenethyl piperidine-4-ketone or 1-phenethyl piperidine-4-ketone | SHANGHAI HOBOR CHEMICAL CO LTD | 2015-12-02 | — | — | CN | disclosed |
| CN-103232433-B | N-substituted benzyl tetrahydropyridine with indole and preparation method and application thereof | UNIV SHANGHAI | 2015-02-25 | — | — | CN | disclosed |
| CN-103524442-A | Pyrimidine compound, triazine compound and application thereof as medicine | LE SUN PHARMACEUTICALS LTD | 2014-01-22 | — | — | CN | disclosed |
| CN-102143953-B | Pyrimidines, triazines and their use as pharmaceutical agents | LE SUN PHARMACEUTICALS LTD | 2013-12-25 | — | — | CN | disclosed |
| CN-103232433-A | N-substituted benzyl tetrahydropyridine with indole and preparation method and application thereof | UNIV SHANGHAI | 2013-08-07 | — | — | CN | disclosed |
| CN-102143953-A | Pyrimidines, triazines and their use as pharmaceutical agents | UNIV NOTTINGHAM | 2011-08-03 | — | — | CN | disclosed |
| EP-0626968-B1 | PIPERIDINYL THIACYCLIC DERIVATIVES | MERRELL PHARMA INC (US) | 2001-09-26 | — | — | EP | disclosed |
| US-5169096-A | Serotonin antagonists, analgesics | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-12-08 | — | — | US | disclosed |
| CN-1065267-A | HETEROCYCLIC-CYCLIC AMINE DERIVATIVES | PFIZER (US) | 1992-10-14 | — | — | CN | disclosed |
| US-5021428-A | Novel chemical compounds for the prophylactic treatment of migraine | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-06-04 | — | — | US | disclosed |
| JP-H02124885-A | IMIDAZOLE ANTIARRHYTHMIC | MERRELL DOW PHARMACEUT INC | 1990-05-14 | — | — | JP | disclosed |
| CN-1041363-A | PROCESS FOR PREPARING IMIDAZOLE ANTIARRHYTHMICS | MERRELL DOW PHARMA (US) | 1990-04-18 | — | — | CN | disclosed |
| US-4912117-A | Therapy for varient angina | MERRELL DOW PHARMACEUTICALS INC. (US) | 1990-03-27 | — | — | US | disclosed |
| EP-0208235-B1 | N-ARALKYL PIPERIDINEMETHANOL DERIVATIVES | MERRELL DOW PHARMACEUTICALS INC. (US) | 1990-01-10 | — | — | EP | disclosed |
| CN-1033805-A | PIPERIDINYL COMPOUNDS | MERRELL DOW PHARMA (US) | 1989-07-12 | — | — | CN | disclosed |
| US-4783471-A | N-aralkyl piperidine methanol derivatives and the uses thereof | MERRELL DOW PHARMACEUTICALS INC. (US) | 1988-11-08 | — | — | US | disclosed |
| EP-0208235-A1 | N-Aralkyl piperidinemethanol derivatives | MERRELL DOW PHARMACEUTICALS INC. (US) | 1987-01-14 | — | — | EP | disclosed |