Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 12/20 | 0.61 |
| ▸ | CES1 | P23141 | 11/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | AKT1 | P31749 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2734464 | 0.80 | EGFR (0.58) | CES2CES1HPGDTSHRAKT1 | |
| SCHEMBL8844303 | 0.79 | CES2 (0.50) | CES2CES1HPGDTSHRAKT1 | |
| Benzil SCHEMBL27395782 | 0.78 | CES2 (0.64) | CES2CES1HPGDTSHRAKT1 | |
| SCHEMBL54072 | 0.78 | KMT2A (0.56) | CES1HPGDTSHRALDH1A1MAPT | |
| Benzene SCHEMBL28216395 | 0.78 | KMT2A (0.56) | CES1HPGDTSHRALDH1A1MAPT | |
| Benzil SCHEMBL422981 | 0.77 | CES2 (0.78) | CES2CES1HPGDTSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL27547476 | 0.77 | NPC1 (0.54) | CES1HPGDTSHRALDH1A1MAPT | |
| SCHEMBL8399349 | 0.77 | NPC1 (0.54) | CES1HPGDTSHRALDH1A1MAPT | |
| SCHEMBL7669290 | 0.76 | CES2 (1.00) | CES2CES1ALDH1A1MAPTL3MBTL1 | |
| SCHEMBL4625390 | 0.76 | CES2 (1.00) | CES2CES1ALDH1A1MAPTL3MBTL1 |
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-0536896-B1 | Imidazolidyl macrolides having immunosuppressive activity | MERCK & CO INC (US) | 1997-12-17 | — | — | EP | disclosed |
| US-5344925-A | Autoimmune diseases; infections; organ transplants | MERCK & CO., INC. (US) | 1994-09-06 | — | — | US | disclosed |
| EP-0431991-B1 | 1,8-Benzonaphthyridine derivatives, their preparation and compositions containing them | BELLON LABOR SA ROGER (FR) | 1994-01-12 | — | — | EP | disclosed |
| US-5247076-A | IMIDAZOLIDYL MACROLIDES HAVING IMMUNOSUPPRESSIVE ACTIVITY | MERCK & CO., INC. (US) | 1993-09-21 | — | — | US | disclosed |
| EP-0536896-A1 | Imidazolidyl macrolides having immunosuppressive activity | MERCK & CO. INC. (US) | 1993-04-14 | — | — | EP | disclosed |
| WO-1993005059-A1 | IMIDAZOLIDYL MACROLIDES | MERCK & CO., INC. (US) | 1993-03-18 | — | — | WO | disclosed |
| EP-0431991-A1 | 1,8-Benzonaphthyridine derivatives, their preparation and compositions containing them | Société anonyme dite: LABORATOIRE ROGER BELLON (FR) | 1991-06-12 | — | — | EP | disclosed |