Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.48 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 11/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | GLA | P06280 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4549476 | 0.86 | MAOB (0.63) | ALDH1A1MAPK1MAOBMAPTTDP1 | |
| SCHEMBL9778201 | 0.83 | ALDH1A1 (0.49) | ALDH1A1MAPK1MAOBMAPTTDP1 | |
| SCHEMBL9778298 | 0.83 | MAPT (0.67) | ALDH1A1MAPK1MAOBMAPTTDP1 | |
| SCHEMBL9778193 | 0.82 | PKM (0.51) | ALDH1A1MAPK1MAOBMAPTTDP1 | |
| SCHEMBL9778415 | 0.80 | MAOB (0.51) | ALDH1A1MAPK1MAOBMAPTTDP1 | |
| SCHEMBL9778310 | 0.80 | MAPT (0.52) | ALDH1A1MAPK1MAPTTDP1CYP1A2 | |
| SCHEMBL125022 | 0.80 | MAPT (0.71) | ALDH1A1MAPK1MAOBMAPTTDP1 | |
| SCHEMBL9778225 | 0.80 | CYP2A6 (0.50) | ALDH1A1MAPK1MAOBMAPTTDP1 | |
| SCHEMBL9778248 | 0.79 | MAPT (0.47) | ALDH1A1MAPK1MAPTTDP1L3MBTL1 | |
| SCHEMBL9778304 | 0.79 | MAOB (0.50) | ALDH1A1MAPK1MAOBMAPTTDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4992203-A | Element comprising pyrazoline compound aligned for net non-centrosymmetry | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-02-12 | — | — | US | disclosed |
| EP-0240106-A2 | Non-linear optical elements and compounds | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-10-07 | — | — | EP | disclosed |