Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.58 |
| ▸ | TAS2R38 | P59533 | 2/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | TYR | P14679 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | GAA | P10253 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 3/20 | 0.50 |
| ▸ | KIF11 | P52732 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL12071790 | 0.86 | ALDH1A1 (0.62) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| SCHEMBL725810 | 0.85 | ALDH1A1 (0.75) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| SCHEMBL652231 | 0.79 | IDO1 (0.63) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| SCHEMBL1882197 | 0.77 | CYP1A2 (0.70) | ALDH1A1CYP3A4HPGDCYP2C19MAPT | |
| SCHEMBL728343 | 0.76 | ALDH1A1 (0.62) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| SCHEMBL1822006 | 0.76 | ALDH1A1 (0.65) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| SCHEMBL674953 | 0.76 | ALDH1A1 (0.76) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| SCHEMBL449122 | 0.74 | ALDH1A1 (0.60) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| SCHEMBL11751583 | 0.74 | ALDH1A1 (0.61) | ALDH1A1TAS2R38HSD17B10TP53TYR | |
| SCHEMBL5518697 | 0.74 | IDO1 (0.63) | ALDH1A1TAS2R38HSD17B10TP53TYR |
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 |
|---|---|---|---|---|---|---|---|
| US-9622991-B2 | Hematopoietic growth factor mimetic small molecule compounds and their uses | LIGAND PHARMACEUTICALS INC. (US) | 2017-04-18 | — | — | US | disclosed |