Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | MEN1 | O00255 | 5/20 | 0.39 |
| ▸ | GAA | P10253 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.38 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.38 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.38 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.38 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.38 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6926419 | 0.73 | MEN1 (0.48) | KMT2AALDH1A1MEN1GAAL3MBTL1 | |
| SCHEMBL7381283 | 0.71 | MAPT (0.41) | KMT2AALDH1A1MEN1GAAL3MBTL1 | |
| SCHEMBL14686282 | 0.69 | CA1 (0.47) | KMT2AALDH1A1MEN1KDM4EPSEN1 | |
| SCHEMBL6920228 | 0.69 | ALDH1A1 (0.49) | KMT2AALDH1A1MEN1GAAL3MBTL1 | |
| SCHEMBL29493203 | 0.65 | IDO1 (0.50) | KMT2AALDH1A1MEN1HPGDTDP1 | |
| SCHEMBL1154758 | 0.65 | IDO1 (0.50) | KMT2AALDH1A1MEN1HPGDTDP1 | |
| SCHEMBL29043085 | 0.65 | MAPT (0.44) | KMT2AALDH1A1MEN1KDM4EHPGD | |
| SCHEMBL6926332 | 0.65 | KMT2A (0.42) | KMT2AALDH1A1MEN1GAAL3MBTL1 | |
| SCHEMBL7379989 | 0.64 | MAPT (0.42) | KMT2AALDH1A1MEN1GAAL3MBTL1 | |
| SCHEMBL2061056 | 0.64 | KDM4E (0.50) | ALDH1A1KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2002050056-A1 | BENZYLAMINE DERIVATIVES AND THEIR USE AS THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 2002-06-27 | — | — | WO | disclosed |