Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 5/20 | 0.54 |
| ▸ | SRD5A1 | P18405 | 4/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.42 |
| ▸ | PLEC | Q15149 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.39 |
| ▸ | RARB | P10826 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27794501 | 0.90 | SRD5A2 (0.58) | SRD5A2SRD5A1ALDH1A1GRM1GRM5 | |
| SCHEMBL11010368 | 0.85 | HSD17B3 (0.48) | SRD5A2SRD5A1ALDH1A1LMNANOTUM | |
| SCHEMBL9778275 | 0.81 | MAPT (0.46) | SRD5A2SRD5A1ALDH1A1GRM1KDM4E | |
| SCHEMBL11015563 | 0.81 | ALDH1A1 (0.42) | SRD5A2SRD5A1ALDH1A1GRM1KDM4E | |
| SCHEMBL11096052 | 0.81 | AKR1C3 (0.43) | SRD5A2SRD5A1ALDH1A1NOTUMPOLB | |
| SCHEMBL10502889 | 0.81 | ALDH1A1 (0.62) | SRD5A2SRD5A1ALDH1A1GRM1KDM4E | |
| SCHEMBL15846800 | 0.80 | SRD5A2 (0.58) | SRD5A2SRD5A1ALDH1A1GRM1GRM5 | |
| SCHEMBL11098487 | 0.79 | ALDH1A1 (0.41) | SRD5A2SRD5A1ALDH1A1PLECHPGD | |
| SCHEMBL11009216 | 0.79 | SRD5A2 (0.40) | SRD5A2SRD5A1ALDH1A1GRM1GRM5 | |
| SCHEMBL30944690 | 0.78 | PLEC (0.51) | SRD5A2PLECKDM4ELMNAMAPT |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0463636-A2 | Cardiovascular composition | MERCK FROSST CANADA INC. (CA) | 1992-01-02 | — | — | EP | claimed |
| EP-0166257-A2 | Cardiovascular composition | MERCK FROSST CANADA INC. (CA) | 1986-01-02 | — | — | EP | claimed |
| US-4536507-A | ANTIASTHMA AGENTS | MERCK & CO., INC. (US) | 1985-08-20 | — | — | US | claimed |
| EP-0011067-B1 | PROSTAGLANDIN ANTAGONISTS, THEIR PRODUCTION AND THEIR PHARMACEUTICAL COMPOSITIONS | MERCK & CO. INC. (US) | 1982-04-21 | — | — | EP | claimed |
| EP-0463636-A2 | Cardiovascular composition | MERCK FROSST CANADA INC. (CA) | 1992-01-02 | — | — | EP | disclosed |
| US-5036067-A | Enzyme inhibotors | MERCK & CO., INC. (US) | 1991-07-30 | — | — | US | disclosed |
| EP-0166257-A2 | Cardiovascular composition | MERCK FROSST CANADA INC. (CA) | 1986-01-02 | — | — | EP | disclosed |
| US-4558037-A | A DIBENZOTHIEPIN COMPOUND AND AN ANGIOTENSIN CONVERTING ENZYME INHIBITOR | MERCK & CO., INC. (US) | 1985-12-10 | — | — | US | disclosed |
| US-4536507-A | ANTIASTHMA AGENTS | MERCK & CO., INC. (US) | 1985-08-20 | — | — | US | disclosed |
| EP-0029587-B1 | 3-HYDROXYMETHYLDIBENZO(B,F)THIEPINS AND DIBENZO(B,F)THIEPIN-3-CARBOXALDEHYDES AS PROSTAGLANDIN ANTAGONISTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS | MERCK SHARP & DOHME (I.A.) CORP. (US) | 1984-06-13 | — | — | EP | disclosed |
| US-4394515-A | 10,11-Dihydro-11-oxodibenzo[b,f]thiepin compounds | MERCK & CO., INC. (US) | 1983-07-19 | — | — | US | disclosed |
| EP-0011067-B1 | PROSTAGLANDIN ANTAGONISTS, THEIR PRODUCTION AND THEIR PHARMACEUTICAL COMPOSITIONS | MERCK & CO. INC. (US) | 1982-04-21 | — | — | EP | disclosed |
| EP-0029587-A1 | 3-Hydroxymethyldibenzo(b,f)thiepins and dibenzo(b,f)thiepin-3-carboxaldehydes as prostaglandin antagonists, process for their preparation and pharmaceutical compositions | MERCK SHARP & DOHME (I.A.) CORP. (US) | 1981-06-03 | — | — | EP | disclosed |
| US-4237160-A | 3-Hydroxymethyldibenzo[b,f]thiepins as prostaglandin antagonists | MERCK SHARP & DOHME (I.A.) CORP. (US) | 1980-12-02 | — | — | US | disclosed |
| EP-0011067-A1 | Prostaglandin antagonists, their production and their pharmaceutical compositions | MERCK & CO. INC. (US) | 1980-05-28 | — | — | EP | disclosed |
| EP-0000978-A1 | 7-and 8-substituted -10,11-dihydro-11-oxodibenzo (b,f) thiepin derivatives, their production and their parmaceutical compositions | MERCK & CO. INC. (US) | 1979-03-07 | — | — | EP | disclosed |