Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.46 |
| ▸ | PDE7A | Q13946 | 5/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
| ▸ | PDE7B | Q9NP56 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28291581 | 0.85 | HSD17B10 (0.60) | HSD17B10KMT2AALDH1A1VCAM1TDP1 | |
| SCHEMBL7786691 | 0.83 | HSD17B10 (0.62) | HSD17B10KMT2AALDH1A1VCAM1PDE7A | |
| SCHEMBL2205749 | 0.83 | HSD17B10 (0.62) | HSD17B10KMT2AALDH1A1VCAM1PDE7A | |
| SCHEMBL868877 | 0.83 | HSD17B10 (0.62) | HSD17B10KMT2AALDH1A1VCAM1PDE7A | |
| SCHEMBL10860961 | 0.83 | HSD17B10 (0.53) | HSD17B10KMT2AALDH1A1VCAM1PDE7A | |
| SCHEMBL7073889 | 0.81 | HSD17B10 (0.60) | HSD17B10KMT2AALDH1A1VCAM1PDE7A | |
| SCHEMBL28978217 | 0.81 | HSD17B10 (0.60) | HSD17B10KMT2AALDH1A1VCAM1PDE7A | |
| SCHEMBL29672035 | 0.81 | HSD17B10 (0.60) | HSD17B10KMT2AALDH1A1VCAM1PDE7A | |
| SCHEMBL508763 | 0.81 | HSD17B10 (0.60) | HSD17B10KMT2AALDH1A1VCAM1PDE7A | |
| SCHEMBL844111 | 0.81 | HSD17B10 (0.60) | HSD17B10KMT2AALDH1A1VCAM1PDE7A |
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-2391603-A1 | AROYLAMINO - AND HETEROAROYLAMINO-SUBSTITUTED PIPERIDINES AS GLYT-1 INHIBITORS | F. Hoffmann-La Roche AG (CH) | 2011-12-07 | — | — | EP | disclosed |
| WO-2010086251-A1 | AROYLAMINO - AND HETEROAROYLAMINO-SUBSTITUTED PIPERIDINES AS GLYT-1 INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2010-08-05 | — | — | WO | disclosed |