Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 12/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.31 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.31 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.31 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.31 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14923323 | 1.00 | HPGD (0.36) | HPGDEPHX1ALDH1A1KDM4EMEN1 | |
| SCHEMBL14923325 | 0.92 | HPGD (0.36) | HPGDEPHX1MEN1KMT2ANPC1 | |
| SCHEMBL17715619 | 0.89 | CTSD (0.38) | HPGDEPHX1KDM4EMEN1KMT2A | |
| SCHEMBL14923346 | 0.87 | HPGD (0.39) | HPGDEPHX1MEN1KMT2ANPC1 | |
| SCHEMBL14923302 | 0.87 | HPGD (0.39) | HPGDEPHX1MEN1KMT2ANPC1 | |
| SCHEMBL14923324 | 0.85 | HPGD (0.34) | HPGDEPHX1ALDH1A1MEN1KMT2A | |
| SCHEMBL14923374 | 0.83 | EPHX1 (0.42) | HPGDEPHX1ALDH1A1MEN1KMT2A | |
| SCHEMBL17715611 | 0.82 | HTR5A (0.43) | HPGDEPHX1ALDH1A1KMT2ANPC1 | |
| SCHEMBL14923312 | 0.82 | HPGD (0.35) | HPGDEPHX1ALDH1A1MEN1KMT2A | |
| SCHEMBL17551587 | 0.81 | HPGD (0.34) | HPGDEPHX1ALDH1A1MEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2343069-B1 | Heterocyclic aspartyl protease inhibitors | MERCK SHARP & DOHME (US) | 2016-03-02 | — | — | EP | disclosed |
| EP-1699455-B1 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2013-05-08 | — | — | EP | disclosed |