Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.35 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 4/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.34 |
| ▸ | MEN1 | O00255 | 4/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | TP53 | P04637 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 3/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6570874 | 0.98 | NOS3 (0.36) | NOS3NOS1GSK3BALDH1A1GAA | |
| SCHEMBL1406553 | 0.85 | ALDH1A1 (0.42) | NOS3NOS1ALDH1A1GAAHTT | |
| SCHEMBL6574540 | 0.84 | PDE10A (0.46) | NOS3NOS1ALDH1A1GAAHTT | |
| Hydrochloric Acid SCHEMBL6572000 | 0.84 | ALDH1A1 (0.41) | NOS3NOS1ALDH1A1GAAHTT | |
| Hydrochloric Acid SCHEMBL6778620 | 0.83 | PDE10A (0.44) | NOS3NOS1ALDH1A1GAAHTT | |
| SCHEMBL6488472 | 0.78 | ALDH1A1 (0.52) | NOS3NOS1ALDH1A1GAAHTT | |
| SCHEMBL2479814 | 0.78 | TDP1 (0.50) | ALDH1A1GAANPC1RAB9ATDP1 | |
| SCHEMBL30075769 | 0.78 | TDP1 (0.50) | ALDH1A1GAANPC1RAB9ATDP1 | |
| Hydrochloric Acid SCHEMBL7691935 | 0.78 | CNR1 (0.36) | ALDH1A1GAAHTTMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL6571929 | 0.76 | TDP1 (0.48) | ALDH1A1GAANPC1RAB9ATDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1051143-B1 | OXIDIZING HAIR COLORING AGENTS CONTAINING 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES AND NOVEL 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES | WELLA AG (DE) | 2004-07-21 | — | — | EP | claimed |
| EP-1051143-B1 | OXIDIZING HAIR COLORING AGENTS CONTAINING 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES AND NOVEL 2,5-DIAMINO-1-PHENYLBENZENE DERIVATIVES | WELLA AG (DE) | 2004-07-21 | — | — | EP | disclosed |