Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.59 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.59 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 6/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.43 |
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | GFER | P55789 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | ESRRG | P62508 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11693529 | 0.83 | CYP2A6 (0.46) | ALDH1A1ALDH3A1ALDH1A3MAPTKMT2A | |
| SCHEMBL16863794 | 0.83 | ALDH1A1 (0.55) | ALDH1A1MAPTGFERHPGDRAB9A | |
| SCHEMBL7038319 | 0.83 | MEN1 (0.49) | ALDH1A1MAPTKDM4EGAAGFER | |
| SCHEMBL11315216 | 0.80 | MAPT (0.44) | ALDH1A1MAPTHPGDRAB9ANPC1 | |
| SCHEMBL10942535 | 0.80 | ALDH1A1 (0.83) | ALDH1A1ALDH3A1ALDH1A3MAPTKDM4E | |
| SCHEMBL7598406 | 0.78 | ALDH1A1 (0.56) | ALDH1A1MAPTKDM4EGAAHPGD | |
| SCHEMBL10938401 | 0.78 | ALDH1A1 (0.67) | ALDH1A1ALDH3A1ALDH1A3MAPTKDM4E | |
| SCHEMBL11695333 | 0.77 | ALDH1A1 (0.49) | ALDH1A1ALDH3A1ALDH1A3MAPTKDM4E | |
| SCHEMBL3190534 | 0.77 | ALDH1A1 (0.71) | ALDH1A1ALDH3A1ALDH1A3MAPTKDM4E | |
| SCHEMBL6129323 | 0.77 | ALDH1A1 (0.61) | ALDH1A1ALDH3A1ALDH1A3MAPTKDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6458966-B1 | Dye intermediate and method | NYCOMED AMERSHAM PLC (GB) | 2002-10-01 | — | — | US | disclosed |
| EP-1002020-A1 | DYE INTERMEDIATE AND METHOD TO MANUFACTURE DYES | Nycomed Amersham plc (GB) | 2000-05-24 | — | — | EP | disclosed |
| WO-1999007793-A1 | DYE INTERMEDIATE AND METHOD TO MANUFACTURE DYES | NYCOMED AMERSHAM PLC (GB) | 1999-02-18 | — | — | WO | disclosed |