Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.49 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.49 |
| ▸ | USP2 | O75604 | 2/20 | 0.49 |
| ▸ | APEX1 | P27695 | 1/20 | 0.49 |
| ▸ | CASP7 | P55210 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.40 |
| ▸ | NCF1 | P14598 | 2/20 | 0.39 |
| ▸ | KCNH3 | Q9ULD8 | 4/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6573372 | 0.90 | MALT1 (0.42) | CYP1A2ALDH1A1CYP2C19CLK4USP2 | |
| SCHEMBL6570699 | 0.85 | ALDH1A1 (0.50) | CYP1A2ALDH1A1CYP2C19CLK4USP2 | |
| SCHEMBL6572283 | 0.85 | PTGER4 (0.39) | CYP1A2ALDH1A1CYP2C19CLK4USP2 | |
| SCHEMBL6571144 | 0.83 | ADRB2 (0.44) | CYP1A2ALDH1A1CYP2C19HSD17B10ALOX15 | |
| SCHEMBL6573074 | 0.83 | ALDH1A1 (0.42) | CYP1A2ALDH1A1CYP2C19CYP3A4KDM4E | |
| SCHEMBL6574643 | 0.82 | PTGER4 (0.40) | CYP1A2ALDH1A1CYP2C19CLK4USP2 | |
| SCHEMBL6334634 | 0.81 | ALDH1A1 (0.45) | CYP1A2ALDH1A1CYP2C19CLK4USP2 | |
| SCHEMBL6573643 | 0.80 | PTGER4 (0.42) | ALDH1A1ALOX15HIF1ACYP3A4NCF1 | |
| SCHEMBL6571575 | 0.79 | ALDH1A1 (0.41) | CYP1A2ALDH1A1CYP2C19CLK4HSD17B10 | |
| SCHEMBL6571382 | 0.79 | PTGER4 (0.38) | CYP1A2ALDH1A1CYP2C19CLK4USP2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| 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 |