Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | IL1RN | P18510 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23440129 | 0.82 | F2 (0.41) | HPGDKDM4EALDH1A1MAPTPARP1 | |
| SCHEMBL23440438 | 0.81 | RAB9A (0.49) | ALDH1A1KMT2AMAPTNPC1RAB9A | |
| Isophthalic Acid SCHEMBL5406230 | 0.80 | HPGD (0.57) | HPGDKDM4EGAAALDH1A1MEN1 | |
| SCHEMBL23440353 | 0.79 | PARP1 (0.44) | HPGDALDH1A1MEN1KMT2APOLB | |
| Isophthalic Acid SCHEMBL5411490 | 0.79 | HPGD (0.56) | HPGDKDM4EGAAALDH1A1MEN1 | |
| Isophthalic Acid SCHEMBL27899309 | 0.76 | HPGD (0.61) | HPGDKDM4EGAAALDH1A1MEN1 | |
| SCHEMBL23440152 | 0.75 | MAPK1 (0.56) | HPGDKDM4EGAAALDH1A1KMT2A | |
| SCHEMBL4696934 | 0.75 | L3MBTL3 (0.72) | HPGDKDM4EGAAALDH1A1MEN1 | |
| SCHEMBL15076720 | 0.73 | L3MBTL3 (0.70) | HPGDKDM4EGAAALDH1A1MEN1 | |
| SCHEMBL23439710 | 0.73 | ALDH1A1 (0.39) | HPGDALDH1A1KMT2AMAPTPOLB |
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-2021105906-A1 | ARYL AND HETEROARYL COMPOUNDS, AND THERAPEUTIC USES THEREOF IN CONDITIONS ASSOCIATED WITH THE ALTERATION OF THE ACTIVITY OF GALACTOCEREBROSIDASE | GAIN THERAPEUTICS SA (CH) | 2021-06-03 | — | — | WO | disclosed |