Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 3/20 | 0.49 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9808291 | 0.89 | KCNH2 (0.57) | KCNH2KCNA3CA12CA1CA2 | |
| Diphenylether SCHEMBL10632533 | 0.82 | LTA4H (0.57) | KCNH2KCNA3CA12CA1CA2 | |
| SCHEMBL10571938 | 0.80 | KCNH2 (0.50) | KCNH2KCNA3CA12CA1CA2 | |
| SCHEMBL10246513 | 0.80 | KCNH2 (0.50) | KCNH2KCNA3CA12CA1CA2 | |
| SCHEMBL1790840 | 0.79 | KCNH2 (0.53) | KCNH2KCNA3CA12CA1CA2 | |
| SCHEMBL14085300 | 0.78 | KCNH2 (0.53) | KCNH2KCNA3CA12CA1CA2 | |
| SCHEMBL4521402 | 0.78 | KCNH2 (0.49) | KCNH2KCNA3CA12CA1CA2 | |
| SCHEMBL3982634 | 0.78 | TAAR1 (0.50) | KCNH2KCNA3CA12CA1CA2 | |
| SCHEMBL5658625 | 0.78 | ALDH1A1 (0.50) | KCNH2KCNA3CA12CA1CA2 | |
| SCHEMBL22163039 | 0.76 | ALDH1A1 (0.42) | KCNH2ALDH1A1RECQLMEN1RAB9A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1178993-A1 | THIAZOLODERIATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Knoll GmbH (DE) | 2002-02-13 | — | — | EP | disclosed |
| WO-2000071549-A1 | THIAZOLODERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | KNOLL GMBH (DE) | 2000-11-30 | — | — | WO | disclosed |
| EP-0836606-B1 | CONDENSED THIAZOLE DERIVATIVES, HAVING 5-HT RECEPTOR AFFINITY | KNOLL AG (DE) | 2000-08-30 | — | — | EP | disclosed |
| US-5869492-A | TREATING CENTRAL NERVOUS SYSTEM DISORDERS | KNOLL AKTIENGESELLSCHAFT (DE) | 1999-02-09 | — | — | US | disclosed |
| EP-0836606-A1 | CONDENSED THIAZOLE DERIVATIVES, HAVING 5-HT RECEPTOR AFFINITY | KNOLL AKTIENGESELLSCHAFT (DE) | 1998-04-22 | — | — | EP | disclosed |
| WO-1997002269-A1 | CONDENSED THIAZOLE DERIVATIVES, HAVING 5-HT RECEPTOR AFFINITY | KNOLL AKTIENGESELLSCHAFT (DE) | 1997-01-23 | — | — | WO | disclosed |