Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.53 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.47 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | BLM | P54132 | 3/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.41 |
| ▸ | CFTR | P13569 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | CASP1 | P29466 | 2/20 | 0.41 |
| ▸ | CASP7 | P55210 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
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 SCHEMBL7807700 | 0.98 | TAAR1 (0.52) | TAAR1ADORA2AADORA1ALOX5EPHX2 | |
| SCHEMBL15695597 | 0.86 | TAAR1 (0.55) | TAAR1ADORA2AADORA1ALOX5EPHX2 | |
| SCHEMBL6873928 | 0.84 | TAAR1 (0.53) | TAAR1ADORA2AADORA1ALOX5EPHX2 | |
| SCHEMBL16600588 | 0.83 | TAAR1 (0.50) | TAAR1ADORA2AADORA1ALDH1A1MAPT | |
| SCHEMBL19199419 | 0.82 | ADORA2A (0.49) | TAAR1ADORA2AADORA1ALDH1A1MAPT | |
| SCHEMBL6136890 | 0.81 | TAAR1 (0.50) | TAAR1ADORA2AADORA1ALOX5EPHX2 | |
| SCHEMBL8586029 | 0.81 | ADORA2A (0.48) | TAAR1ADORA2AADORA1ALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL6137158 | 0.79 | TAAR1 (0.48) | TAAR1ADORA2AADORA1ALOX5EPHX2 | |
| SCHEMBL2008325 | 0.79 | TAAR1 (0.45) | TAAR1ADORA2AADORA1ALDH1A1MAPT | |
| SCHEMBL5704940 | 0.78 | TAAR1 (0.52) | TAAR1ADORA2AADORA1ALOX5EPHX2 |
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 7 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 | claimed |
| US-6042620-A | FOR DYEING KERATIN FIBERS SUCH AS HAIR | WELLA AG (DE) | 2000-03-28 | — | — | US | claimed |
| EP-0943614-A2 | Dyeing agents comprising diaminobenzene derivatives and the diaminobenzene derivatives | Wella Aktiengesellschaft (DE) | 1999-09-22 | — | — | EP | claimed |
| CN-105814066-A | Azaborinine derivatives, their synthesis and use in organic electronic devices | 默克专利股份有限公司 | 2016-07-27 | — | — | CN | disclosed |
| 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 |