Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 1/20 | 0.43 |
| ▸ | ACLY | P53396 | 1/20 | 0.43 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.42 |
| ▸ | SLC16A3 | O15427 | 4/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.41 |
| ▸ | GHSR | Q92847 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6984823 | 0.81 | HTR6 (0.48) | RECQLALDH1A1LMNAGAAMAPT | |
| SCHEMBL4073038 | 0.80 | KMT2A (0.53) | ALDH1A1LMNAGAAL3MBTL1MEN1 | |
| SCHEMBL6976544 | 0.80 | MEN1 (0.53) | TSHRALDH1A1LMNAMEN1KMT2A | |
| SCHEMBL6983095 | 0.76 | BRD4 (0.51) | TSHRPGRGHSRALDH1A1HTR6 | |
| SCHEMBL10240505 | 0.76 | HTR6 (0.48) | HCRTR1ACLYKCNA5SLC16A3RECQL | |
| SCHEMBL10238852 | 0.76 | HTR6 (0.51) | HCRTR1ACLYKCNA5SLC16A3RECQL | |
| SCHEMBL6985112 | 0.75 | ALDH1A1 (0.64) | TSHRALDH1A1LMNAGAAMAPT | |
| SCHEMBL6985321 | 0.75 | ALDH1A1 (0.48) | ALDH1A1LMNAGAAMAPTMEN1 | |
| SCHEMBL6986762 | 0.75 | ALDH1A1 (0.53) | TSHRALDH1A1LMNAGAAMAPT | |
| SCHEMBL6982220 | 0.75 | ALDH1A1 (0.64) | KCNA5ALDH1A1LMNAGAAHTR6 |
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 |