Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.45 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HPGDS | O60760 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17204873 | 0.92 | KDM4E (0.60) | ALDH1A1KDM4EGAAPOLBRAB9A | |
| SCHEMBL17205302 | 0.81 | HDAC6 (0.38) | ALDH1A1KDM4EGAAPOLBRAB9A | |
| SCHEMBL17205055 | 0.76 | ALDH1A1 (0.39) | ALDH1A1KDM4EGAAPOLBRAB9A | |
| SCHEMBL17201580 | 0.71 | KDM4E (0.68) | ALDH1A1KDM4EGAAPOLBRAB9A | |
| SCHEMBL6261025 | 0.70 | KDM4E (0.71) | ALDH1A1KDM4EGAAPOLBRAB9A | |
| SCHEMBL6259708 | 0.70 | KDM4E (1.00) | ALDH1A1KDM4EGAAPOLBRAB9A | |
| SCHEMBL6260309 | 0.68 | ALDH1A1 (0.62) | ALDH1A1KDM4EGAAPOLBRAB9A | |
| SCHEMBL17208101 | 0.68 | MKNK1 (0.70) | ALDH1A1KDM4EGAAPOLBRAB9A | |
| SCHEMBL12922044 | 0.67 | KDM4E (0.71) | ALDH1A1KDM4EGAAPOLBRAB9A | |
| SCHEMBL17212172 | 0.67 | KDM4E (0.71) | ALDH1A1KDM4EGAAPOLBRAB9A |
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-3134414-A1 | 3-OXO-TETRAHYDRO-FURO[3,2-B]PYRROL-4(5H)-YL) DERIVATIVES II | Grünenthal GmbH (DE) | 2017-03-01 | — | — | EP | disclosed |
| WO-2015161924-A1 | 3-OXO-TETRAHYDRO-FURO[3,2-B]PYRROL-4(5H)-YL) DERIVATIVES II | Grünenthal GmbH (DE) | 2015-10-29 | — | — | WO | disclosed |