Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CASR | P41180 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.32 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 2/20 | 0.31 |
| ▸ | ABL1 | P00519 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 4/20 | 0.31 |
| ▸ | MAOA | P21397 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7559183 | 0.90 | SRC (0.41) | CYP2D6MAPTCA12CA1CA9 | |
| SCHEMBL7554171 | 0.87 | CYP2D6 (0.35) | CYP2D6MAPTALDH1A1KDM4EMAPK1 | |
| SCHEMBL7552774 | 0.86 | RAB9A (0.40) | CYP2D6MAPTALDH1A1KDM4EMAPK1 | |
| SCHEMBL7555125 | 0.86 | RAB9A (0.40) | CYP2D6MAPTALDH1A1KDM4EMAPK1 | |
| SCHEMBL8598085 | 0.85 | CYP2D6 (0.39) | CYP2D6MAPTALDH1A1KDM4EMAPK1 | |
| SCHEMBL7556418 | 0.85 | CYP2D6 (0.39) | CYP2D6MAPTALDH1A1KDM4EMAPK1 | |
| SCHEMBL7560574 | 0.84 | RARB (0.39) | CYP2D6MAPTALDH1A1KDM4EMAPK1 | |
| SCHEMBL7557596 | 0.83 | RAB9A (0.45) | CYP2D6MAPTALDH1A1KDM4EMAPK1 | |
| SCHEMBL7556786 | 0.83 | RAB9A (0.45) | CYP2D6MAPTALDH1A1KDM4EMAPK1 | |
| SCHEMBL7552062 | 0.83 | SMN1; SMN2 (0.32) | MAPTALDH1A1NPC1TP53RAB9A |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2580207-A1 | NITROGEN CONTAINING HETEROARYL COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2013-04-17 | — | — | EP | claimed |
| WO-2011154327-A1 | NITROGEN CONTAINING HETEROARYL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-12-15 | — | — | WO | claimed |
| EP-2580207-A1 | NITROGEN CONTAINING HETEROARYL COMPOUNDS | F. Hoffmann-La Roche AG (CH) | 2013-04-17 | — | — | EP | disclosed |
| WO-2011154327-A1 | NITROGEN CONTAINING HETEROARYL COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-12-15 | — | — | WO | disclosed |
| EP-0708165-B1 | Liquid crystal, liquid crystal mixture and liquid crystal device comprising the same | SUMITOMO CHEMICAL CO (JP) | 2002-01-09 | — | — | EP | disclosed |
| US-6246452-B1 | FERROELECTRIC CHIRAL SMECTIC LIQUID CRYSTAL MIXTURE HAVING IMPROVED RESPONSE SPEED WHICH CAN BE USED AS AN OPTICAL SHUTTER OR DISPLAY DEVICE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2001-06-12 | — | — | US | disclosed |
| EP-0667384-B1 | Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same | SUMITOMO CHEMICAL CO (JP) | 1998-12-16 | — | — | EP | disclosed |
| US-5779934-A | FLUORINATING AN ALCOHOL DERIVATIVE | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1998-07-14 | — | — | US | disclosed |
| EP-0708165-A1 | Liquid crystal, liquid crystal mixture and liquid crystal device comprising the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1996-04-24 | — | — | EP | disclosed |
| EP-0667384-A1 | Fluorine-containing optically active compound, process for preparing the same and liquid crystal mixture and liquid crystal element comprising the same | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 1995-08-16 | — | — | EP | disclosed |