Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 3/20 | 0.56 |
| ▸ | TP53 | P04637 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | BID | P55957 | 3/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.42 |
| ▸ | BCL2L1 | Q07817 | 2/20 | 0.42 |
| ▸ | BAK1 | Q16611 | 2/20 | 0.42 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | EP300 | Q09472 | 1/20 | 0.42 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9114093 | 0.86 | PRKCI (0.47) | TYRTP53CYP3A4ALOX5MEN1 | |
| SCHEMBL11866128 | 0.85 | TYR (0.62) | TYRTP53CYP3A4ALOX5MEN1 | |
| SCHEMBL11870059 | 0.84 | TYR (0.60) | TYRTP53CYP3A4ALOX5MEN1 | |
| SCHEMBL573936 | 0.83 | BID (0.57) | TYRTP53CYP3A4ALOX5MEN1 | |
| SCHEMBL15995366 | 0.81 | BID (0.59) | TYRTP53CYP3A4ALOX5MEN1 | |
| SCHEMBL574605 | 0.81 | BID (0.59) | TYRTP53CYP3A4ALOX5MEN1 | |
| SCHEMBL27462450 | 0.81 | BID (0.59) | TYRTP53CYP3A4ALOX5MEN1 | |
| SCHEMBL574395 | 0.81 | BID (0.59) | TYRTP53CYP3A4ALOX5MEN1 | |
| SCHEMBL70495 | 0.81 | TYR (0.56) | TYRTP53CYP3A4ALOX5MEN1 | |
| SCHEMBL9706286 | 0.79 | TYR (0.54) | TYRTP53CYP3A4ALOX5MEN1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0240256-B1 | COMPOUNDS USEFUL IN TREATING SICKLE CELL ANEMIA | MERCK & CO. INC. (US) | 1992-04-29 | — | — | EP | disclosed |
| US-4731473-A | Compounds useful in treating sickle cell anemia | MERCK & CO., INC. (US) | 1988-03-15 | — | — | US | disclosed |
| US-4731381-A | Method of treating a person for sickle cell anemia | MERCK & CO., INC. (US) | 1988-03-15 | — | — | US | disclosed |
| US-4699926-A | Compounds useful in treating sickle cell anemia | MERCK & CO., INC. (US) | 1987-10-13 | — | — | US | disclosed |
| EP-0240256-A2 | Compounds useful in treating sickle cell anemia | MERCK & CO. INC. (US) | 1987-10-07 | — | — | EP | disclosed |
| EP-0023728-B1 | ANISOTROPIC COMPOUNDS WITH NEGATIVE OR POSITIVE DIRECT ANISOTROPY AND LIMITED OPTICAL ANISOTROPY, AND LIQUID CRYSTAL MIXTURES CONTAINING THEM | MERCK PATENT GmbH (DE) | 1983-08-10 | — | — | EP | disclosed |
| US-4368135-A | Anisotropic compounds with negative or positive DC-anisotropy and low optical anisotropy | BBC, BROWN, BOVERI & COMPANY, LTD. (CH) | 1983-01-11 | — | — | US | disclosed |
| EP-0023728-A1 | Anisotropic compounds with negative or positive direct anisotropy and limited optical anisotropy, and liquid crystal mixtures containing them | MERCK PATENT GmbH (DE) | 1981-02-11 | — | — | EP | disclosed |