Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.65 |
| ▸ | HPGD | P15428 | 4/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.55 |
| ▸ | MC4R | P32245 | 1/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.47 |
| ▸ | DDB1 | Q16531 | 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 | |
|---|---|---|---|---|
| SCHEMBL30987468 | 1.00 | ALDH1A1 (0.65) | ALDH1A1HPGDHSD17B10MAPTPKM | |
| SCHEMBL2653818 | 1.00 | ALDH1A1 (0.65) | ALDH1A1HPGDHSD17B10MAPTPKM | |
| SCHEMBL18935574 | 0.98 | ALDH1A1 (0.62) | ALDH1A1HPGDHSD17B10MAPTPKM | |
| SCHEMBL7201032 | 0.94 | ALDH1A1 (0.57) | ALDH1A1HPGDHSD17B10MAPTPKM | |
| SCHEMBL30212234 | 0.94 | ALDH1A1 (0.57) | ALDH1A1HPGDHSD17B10MAPTPKM | |
| Bicarbonate SCHEMBL14811674 | 0.93 | ALDH1A1 (0.58) | ALDH1A1HPGDHSD17B10MAPTPKM | |
| SCHEMBL2665681 | 0.89 | L3MBTL1 (0.54) | ALDH1A1HPGDHSD17B10MAPTPKM | |
| SCHEMBL9625796 | 0.89 | L3MBTL1 (0.54) | ALDH1A1HPGDHSD17B10MAPTPKM | |
| SCHEMBL109413 | 0.87 | ALDH1A1 (0.53) | ALDH1A1HPGDHSD17B10MAPTPKM | |
| SCHEMBL29600139 | 0.87 | ALDH1A1 (0.53) | ALDH1A1HPGDHSD17B10MAPTPKM |
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-3481826-B1 | TYROSINE KINASE INHIBITORS | RIGEL PHARMACEUTICALS INC (US) | 2021-11-03 | — | — | EP | disclosed |