Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 5/20 | 0.41 |
| ▸ | PNMT | P11086 | 1/20 | 0.41 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.39 |
| ▸ | MELK | Q14680 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR2B | P41595 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | PRKACA | P17612 | 1/20 | 0.34 |
| ▸ | PRKACG | P22612 | 1/20 | 0.34 |
| ▸ | PRKACB | P22694 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 SCHEMBL14721151 | 0.98 | HTR2C (0.43) | MAOAMAOBPIM1PIM2HTR2C | |
| SCHEMBL14731172 | 0.93 | MAOA (0.39) | MAOAMAOBPIM1PIM2HTR2C | |
| Hydrochloric Acid SCHEMBL14720846 | 0.91 | HTR2C (0.39) | MAOAMAOBPIM1PIM2HTR2C | |
| Hydrochloric Acid SCHEMBL14720845 | 0.91 | HTR2C (0.39) | MAOAMAOBPIM1PIM2HTR2C | |
| SCHEMBL26187508 | 0.88 | PNMT (0.43) | MAOAMAOBPIM1PIM2HTR2C | |
| SCHEMBL26187260 | 0.88 | PNMT (0.43) | MAOAMAOBPIM1PIM2HTR2C | |
| SCHEMBL30624764 | 0.88 | PNMT (0.43) | MAOAMAOBPIM1PIM2HTR2C | |
| SCHEMBL12891140 | 0.84 | MAOA (0.45) | MAOAMAOBPIM1PIM2KMT2A | |
| SCHEMBL23414996 | 0.80 | MAOA (0.42) | MAOAMAOBPIM1PIM2KMT2A | |
| SCHEMBL16322736 | 0.79 | HTR2C (0.48) | PIM1PIM2HTR2CPNMTHRH3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013027001-A1 | COMPOUNDS AND THEIR USE TO TREAT HISTAMINE H3 RELATED DISORDERS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2013-02-28 | — | — | WO | disclosed |