Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | SLC40A1 | Q9NP59 | 7/20 | 0.51 |
| ▸ | METAP2 | P50579 | 2/20 | 0.51 |
| ▸ | METAP1 | P53582 | 2/20 | 0.51 |
| ▸ | GLO1 | Q04760 | 2/20 | 0.51 |
| ▸ | G6PD | P11413 | 1/20 | 0.51 |
| ▸ | NFKBIA | P25963 | 1/20 | 0.51 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.51 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL27214155 | 0.84 | SLC40A1 (0.52) | ABCB1ALDH1A1HPGDSLC40A1METAP2 | |
| SCHEMBL30925438 | 0.84 | SLC40A1 (0.52) | ABCB1ALDH1A1HPGDSLC40A1METAP2 | |
| SCHEMBL27947219 | 0.84 | SLC40A1 (0.50) | ABCB1ALDH1A1HPGDSLC40A1METAP2 | |
| SCHEMBL27947226 | 0.84 | SLC40A1 (0.50) | ABCB1ALDH1A1HPGDSLC40A1METAP2 | |
| SCHEMBL11472070 | 0.77 | TSHR (0.50) | ALDH1A1HPGDSLC40A1METAP2METAP1 | |
| SCHEMBL11471689 | 0.77 | TSHR (0.50) | ALDH1A1HPGDSLC40A1METAP2METAP1 | |
| SCHEMBL11472114 | 0.77 | TSHR (0.50) | ALDH1A1HPGDSLC40A1METAP2METAP1 | |
| SCHEMBL11467633 | 0.77 | TSHR (0.50) | ALDH1A1HPGDSLC40A1METAP2METAP1 | |
| SCHEMBL11478307 | 0.77 | TSHR (0.50) | ALDH1A1HPGDSLC40A1METAP2METAP1 | |
| SCHEMBL11468790 | 0.77 | TSHR (0.50) | ALDH1A1HPGDSLC40A1METAP2METAP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0991624-B1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA (DE) | 2003-11-19 | — | — | EP | disclosed |
| EP-0991624-A1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | Boehringer Ingelheim Pharma KG (DE) | 2000-04-12 | — | — | EP | disclosed |
| WO-1999000371-A1 | PHENYLALKYL DERIVATIVES WITH THROMBIN-INHIBITING EFFECT | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1999-01-07 | — | — | WO | disclosed |