Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | PRKCA | P17252 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.31 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.31 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.31 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7808724 | 0.92 | EGFR (0.34) | ALDH1A1EGFRRORCTBK1ADRA1D | |
| SCHEMBL7812211 | 0.85 | TP53 (0.35) | KCNH3 | |
| SCHEMBL7807622 | 0.83 | EGFR (0.31) | EGFRRORC | |
| SCHEMBL7805904 | 0.82 | PTGER4 (0.35) | ALDH1A1EGFRKCNH3SYKTBK1 | |
| SCHEMBL7808565 | 0.80 | GSK3B (0.36) | ALDH1A1PRKCAGSK3BRORC | |
| SCHEMBL7805929 | 0.78 | PCSK9 (0.33) | ALDH1A1EGFRRORCTBK1ADRA1D | |
| SCHEMBL7807390 | 0.77 | ADRA1D (0.36) | ALDH1A1ADRA1DADRA1ANUDT1 | |
| SCHEMBL7462730 | 0.77 | ALDH1A1 (0.40) | ALDH1A1PRKCAGSK3BKDRSYK | |
| SCHEMBL6573335 | 0.76 | ALDH1A1 (0.44) | ALDH1A1PRKCAGSK3BKDRKCNH3 | |
| SCHEMBL7808513 | 0.74 | MAPT (0.35) | ALDH1A1ADRA1DADRA1ARAB9AEPHX2 |
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 |