Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.43 |
| ▸ | LMNA | P02545 | 6/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8573836 | 0.92 | CYP1A2 (0.49) | CYP1A2CYP2C19CYP2C9ALDH1A1LMNA | |
| SCHEMBL8579261 | 0.84 | CYP1A2 (0.36) | CYP1A2CYP2C19CYP2C9ALDH1A1LMNA | |
| SCHEMBL1485823 | 0.82 | CYP1A2 (0.56) | CYP1A2CYP2C19CYP2C9ALDH1A1LMNA | |
| SCHEMBL9294260 | 0.81 | CYP1A2 (0.54) | CYP1A2CYP2C19CYP2C9ALDH1A1LMNA | |
| SCHEMBL17197393 | 0.80 | CYP1A2 (0.62) | CYP1A2CYP2C19CYP2C9ALDH1A1LMNA | |
| SCHEMBL13884056 | 0.79 | CYP1A2 (0.66) | CYP1A2CYP2C19CYP2C9ALDH1A1LMNA | |
| SCHEMBL8579133 | 0.79 | S1PR3 (0.40) | CYP1A2CYP2C19CYP2C9ALDH1A1LMNA | |
| SCHEMBL9294258 | 0.78 | CYP1A2 (0.54) | CYP1A2CYP2C19CYP2C9ALDH1A1LMNA | |
| SCHEMBL29495066 | 0.78 | CYP1A2 (0.54) | CYP1A2CYP2C19CYP2C9ALDH1A1LMNA | |
| SCHEMBL2447323 | 0.78 | CYP1A2 (0.54) | CYP1A2CYP2C19CYP2C9ALDH1A1LMNA |
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-5744622-A | water-soluble, fiber-reactive anthraquinone compounds | HOECHST AKTIENGESELLSCHAFT (DE) | 1998-04-28 | — | — | US | disclosed |
| EP-0501266-B1 | Bifunctional reactive dyes | BAYER AG (DE) | 1995-06-21 | — | — | EP | disclosed |
| EP-0501266-A1 | Bifunctional reactive dyes | BAYER AG (DE) | 1992-09-02 | — | — | EP | disclosed |