Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.52 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | ALPL | P05186 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CASP1 | P29466 | 1/20 | 0.47 |
| ▸ | CASP7 | P55210 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4288644 | 0.88 | ALDH1A1 (0.59) | NPC1RAB9ATSHRMAPK10ALDH1A1 | |
| SCHEMBL5267582 | 0.87 | LMNA (0.56) | NPC1RAB9ATSHRMAPK10ALDH1A1 | |
| SCHEMBL5270571 | 0.84 | KMT2A (0.59) | NPC1RAB9ATSHRMAPK10ALDH1A1 | |
| SCHEMBL5266469 | 0.82 | SMN1; SMN2 (0.56) | NPC1RAB9AALDH1A1L3MBTL1GAA | |
| SCHEMBL5269233 | 0.81 | KMT2A (0.51) | NPC1RAB9ATSHRALDH1A1L3MBTL1 | |
| SCHEMBL5268734 | 0.81 | KDM4E (0.51) | NPC1RAB9AALDH1A1GAALMNA | |
| SCHEMBL5271648 | 0.79 | KMT2A (0.54) | NPC1RAB9AALDH1A1L3MBTL1LMNA | |
| SCHEMBL5267455 | 0.79 | SMN1; SMN2 (0.63) | TSHRALDH1A1HSD17B10L3MBTL1LMNA | |
| SCHEMBL5265290 | 0.79 | KDM4E (0.46) | NPC1RAB9ATSHRALDH1A1HSD17B10 | |
| SCHEMBL5271587 | 0.79 | HPGD (0.51) | NPC1RAB9ATSHRHPGDTP53 |
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-1847531-A1 | PYRAZOLE COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2007-10-24 | — | — | EP | disclosed |