Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 5/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | CRHBP | P24387 | 2/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.38 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL30561236 | 0.87 | C5AR1 (0.34) | HSD17B10SMN1; SMN2HTTMAPK1MEN1 | |
| SCHEMBL16141553 | 0.78 | ALDH1A1 (0.38) | HSD17B10SMN1; SMN2HTTMAPK1MEN1 | |
| SCHEMBL17473436 | 0.76 | ALDH1A1 (0.41) | HSD17B10SMN1; SMN2HTTMAPK1MEN1 | |
| SCHEMBL2449868 | 0.73 | KDM4E (0.52) | HSD17B10SMN1; SMN2HTTMEN1KMT2A | |
| SCHEMBL19720475 | 0.71 | PDE3B (0.36) | — | |
| SCHEMBL17473524 | 0.67 | HRH4 (0.39) | HSD17B10LMNAALDH1A1TSHRKDM4E | |
| SCHEMBL7712326 | 0.67 | GAA (0.70) | HSD17B10SMN1; SMN2HTTMAPK1MEN1 | |
| SCHEMBL12126202 | 0.66 | MAP3K12 (0.42) | ALDH1A1KDM4ETDP1 | |
| SCHEMBL24156395 | 0.65 | TP53 (0.43) | LMNATP53 | |
| SCHEMBL16141563 | 0.65 | ALDH1A1 (0.36) | HSD17B10SMN1; SMN2HTTMAPK1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2980089-B1 | HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICALS CO (JP) | 2017-12-20 | — | — | EP | disclosed |