Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | DHODH | Q02127 | 8/20 | 0.53 |
| ▸ | CDC7 | O00311 | 4/20 | 0.53 |
| ▸ | DBF4 | Q9UBU7 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.49 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL1340195 | 0.87 | TRPM8 (0.65) | ALDH1A1HSD17B10HPGDDHODHCDC7 | |
| SCHEMBL1966336 | 0.87 | DHODH (0.59) | ALDH1A1HSD17B10HPGDDHODHCDC7 | |
| SCHEMBL1968418 | 0.87 | TRPM8 (0.65) | ALDH1A1HSD17B10HPGDDHODHCDC7 | |
| SCHEMBL11164259 | 0.87 | ALDH1A1 (0.77) | ALDH1A1HSD17B10HPGDDHODHCDC7 | |
| SCHEMBL11281010 | 0.87 | ALDH1A1 (0.55) | ALDH1A1HSD17B10HPGDDHODHCDC7 | |
| SCHEMBL8823153 | 0.86 | ALDH1A1 (0.75) | ALDH1A1HSD17B10HPGDDHODHCDC7 | |
| SCHEMBL1970502 | 0.84 | MAPT (0.67) | ALDH1A1HSD17B10HPGDDHODHCDC7 | |
| SCHEMBL1968834 | 0.83 | TRPM8 (0.60) | ALDH1A1HSD17B10HPGDDHODHCDC7 | |
| SCHEMBL6766164 | 0.83 | DHODH (0.60) | ALDH1A1HSD17B10HPGDDHODHCDC7 | |
| SCHEMBL1398685 | 0.82 | MAPK14 (0.52) | ALDH1A1DHODHCDC7DBF4KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008087611-A2 | PYRROLIDINE- AND PIPERIDINE- BIS-AMIDE DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2008-07-24 | — | — | WO | disclosed |