Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A3 | P43003 | 2/20 | 0.48 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.48 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | METAP2 | P50579 | 3/20 | 0.45 |
| ▸ | METAP1 | P53582 | 3/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | ECE1 | P42892 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5326799 | 1.00 | SLC1A3 (0.48) | SLC1A3SLC1A2SLC1A1ALOX5ALDH1A1 | |
| SCHEMBL29628527 | 1.00 | SLC1A3 (0.48) | SLC1A3SLC1A2SLC1A1ALOX5ALDH1A1 | |
| SCHEMBL26966061 | 1.00 | SLC1A3 (0.48) | SLC1A3SLC1A2SLC1A1ALOX5ALDH1A1 | |
| SCHEMBL19682744 | 1.00 | SLC1A3 (0.48) | SLC1A3SLC1A2SLC1A1ALOX5ALDH1A1 | |
| SCHEMBL6460441 | 0.90 | SLC1A3 (0.46) | SLC1A3SLC1A2SLC1A1ALOX5ALDH1A1 | |
| SCHEMBL6460442 | 0.90 | SLC1A3 (0.46) | SLC1A3SLC1A2SLC1A1ALOX5ALDH1A1 | |
| SCHEMBL5028930 | 0.87 | ALOX5 (0.48) | ALOX5ALDH1A1METAP2METAP1CYP2C9 | |
| SCHEMBL6464059 | 0.86 | ALDH1A1 (0.49) | SLC1A3SLC1A2SLC1A1ALOX5ALDH1A1 | |
| SCHEMBL6464051 | 0.86 | ALDH1A1 (0.49) | SLC1A3SLC1A2SLC1A1ALOX5ALDH1A1 | |
| SCHEMBL19682577 | 0.82 | SLC1A1 (0.42) | SLC1A3SLC1A2SLC1A1 |
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-0699074-B1 | THROMBIN INHIBITORS | MERCK & CO INC (US) | 2002-11-13 | — | — | EP | claimed |
| EP-0699074-A4 | THROMBIN INHIBITORS | MERCK & CO INC (US) | 1998-03-11 | — | — | EP | claimed |
| EP-0699074-A1 | THROMBIN INHIBITORS | MERCK & CO. INC. (US) | 1996-03-06 | — | — | EP | claimed |
| WO-1994025051-A1 | THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 1994-11-10 | — | — | WO | claimed |
| EP-0699074-B1 | THROMBIN INHIBITORS | MERCK & CO INC (US) | 2002-11-13 | — | — | EP | disclosed |
| EP-0699074-A4 | THROMBIN INHIBITORS | MERCK & CO INC (US) | 1998-03-11 | — | — | EP | disclosed |
| EP-0699074-A1 | THROMBIN INHIBITORS | MERCK & CO. INC. (US) | 1996-03-06 | — | — | EP | disclosed |
| WO-1994025051-A1 | THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 1994-11-10 | — | — | WO | disclosed |