Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2E1 | P05181 | 5/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.37 |
| ▸ | CYP2B6 | P20813 | 5/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.37 |
| ▸ | CYP2C8 | P10632 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.34 |
| ▸ | MEN1 | O00255 | 5/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | CASP1 | P29466 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7800718 | 0.84 | CYP2A6 (0.46) | CYP2E1CYP2A6CYP2B6CYP2C19CYP1A2 | |
| SCHEMBL7807529 | 0.77 | ALDH1A1 (0.43) | CYP3A4KMT2AMEN1NPC1RAB9A | |
| SCHEMBL7808580 | 0.75 | S100B (0.35) | CYP2E1CYP2A6CYP2B6CYP2C19CYP1A2 | |
| SCHEMBL7809799 | 0.75 | GRIN2B (0.31) | CYP2E1CYP2A6CYP2B6CYP2C19CYP1A2 | |
| Hydrochloric Acid SCHEMBL7806014 | 0.75 | ALDH1A1 (0.42) | CYP2E1CYP2A6CYP2B6CYP2C19CYP1A2 | |
| SCHEMBL7807647 | 0.72 | ALDH1A1 (0.32) | CYP3A4KMT2AMEN1ALDH1A1CASP1 | |
| SCHEMBL13621245 | 0.72 | DPP4 (0.41) | CYP2E1CYP2A6CYP2B6CYP2C19CYP1A2 | |
| SCHEMBL16600200 | 0.71 | CYP2E1 (0.43) | CYP2E1CYP2A6CYP2B6CYP2C19CYP1A2 | |
| SCHEMBL7455964 | 0.71 | ALDH1A1 (0.36) | KMT2AMEN1NPC1RAB9AALDH1A1 | |
| SCHEMBL7808890 | 0.71 | NOS3 (0.33) | KMT2AMEN1NPC1RAB9AALDH1A1 |
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-0943614-B1 | Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives | WELLA AG (DE) | 2001-12-12 | — | — | EP | disclosed |
| US-6042620-A | FOR DYEING KERATIN FIBERS SUCH AS HAIR | WELLA AG (DE) | 2000-03-28 | — | — | US | disclosed |
| EP-0943614-A2 | Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives | Wella Aktiengesellschaft (DE) | 1999-09-22 | — | — | EP | disclosed |