Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MYC | P01106 | 1/20 | 0.38 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.36 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7688679 | 0.86 | KEAP1 (0.40) | MAPK1RAB9AALDH1A1MEN1KMT2A | |
| SCHEMBL6573305 | 0.85 | MEN1 (0.37) | MAPK1RAB9AALDH1A1MEN1KMT2A | |
| SCHEMBL6575117 | 0.85 | HTT (0.42) | LTB4R2ALDH1A1MEN1KMT2AMYC | |
| SCHEMBL6573015 | 0.82 | CRHR1 (0.36) | MAPK1RAB9AALDH1A1MEN1KMT2A | |
| SCHEMBL6571969 | 0.81 | CRHR1 (0.42) | MAPK1RAB9AALDH1A1MEN1KMT2A | |
| SCHEMBL6573046 | 0.80 | HTR7 (0.44) | MAPK1ALDH1A1CYP3A4HTTTSHR | |
| SCHEMBL6570965 | 0.80 | PLA2G7 (0.50) | RAB9AALDH1A1MEN1KMT2ACYP3A4 | |
| SCHEMBL6574564 | 0.80 | CRHR1 (0.36) | MAPK1RAB9AALDH1A1MEN1KMT2A | |
| SCHEMBL6572689 | 0.79 | RARB (0.41) | ALDH1A1 | |
| SCHEMBL6574203 | 0.79 | CRHR1 (0.34) | MAPK1RAB9AALDH1A1MEN1KMT2A |
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 |
| US-6500213-B1 | Oxidizing hair coloring agents containing 2,5-diamino-1-phenylbenzene derivatives and novel 2,5-diamino-1-phenylbenzene derivatives | WELLA AKTIENGESELLSCHAFT (DE) | 2002-12-31 | — | — | US | disclosed |