Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.50 |
| ▸ | CASP1 | P29466 | 2/20 | 0.50 |
| ▸ | NPEPPS | P55786 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7214700 | 1.00 | MAPT (0.51) | MAPTPKMKDM4EHSD17B10CASP1 | |
| SCHEMBL7214703 | 1.00 | MAPT (0.51) | MAPTPKMKDM4EHSD17B10CASP1 | |
| SCHEMBL30686534 | 0.89 | MAPT (0.57) | MAPTPKMKDM4EHSD17B10CASP1 | |
| SCHEMBL14059266 | 0.84 | KDM4E (0.51) | MAPTPKMKDM4EHSD17B10CASP1 | |
| SCHEMBL901459 | 0.84 | KDM4E (0.51) | MAPTPKMKDM4EHSD17B10CASP1 | |
| SCHEMBL902977 | 0.84 | KDM4E (0.51) | MAPTPKMKDM4EHSD17B10CASP1 | |
| SCHEMBL902409 | 0.84 | KDM4E (0.51) | MAPTPKMKDM4EHSD17B10CASP1 | |
| SCHEMBL901429 | 0.84 | KDM4E (0.51) | MAPTPKMKDM4EHSD17B10CASP1 | |
| SCHEMBL3552839 | 0.80 | MAPT (0.76) | MAPTPKMALDH1A1SMN1; SMN2CYP2C19 | |
| SCHEMBL7887174 | 0.80 | MAPT (0.76) | MAPTPKMALDH1A1SMN1; SMN2CYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6610692-B1 | Anticoagulants | MERCK & CO., INC. | 2003-08-26 | — | — | US | disclosed |
| EP-1124822-A4 | THROMBIN INHIBITORS | MERCK & CO INC (US) | 2002-04-03 | — | — | EP | disclosed |
| EP-1124822-A1 | THROMBIN INHIBITORS | Merck & Co., Inc. (US) | 2001-08-22 | — | — | EP | disclosed |
| WO-2000026211-A1 | THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 2000-05-11 | — | — | WO | disclosed |