Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 10/20 | 0.39 |
| ▸ | TP53 | P04637 | 9/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.37 |
| ▸ | NPC1 | O15118 | 5/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27362944 | 0.85 | SMN1; SMN2 (0.41) | MAPTTP53RXFP1ALDH1A1PKM | |
| SCHEMBL29924707 | 0.83 | MAPT (0.53) | MAPTTP53ALDH1A1PKMSMN1; SMN2 | |
| SCHEMBL27362971 | 0.82 | HPGD (0.51) | MAPTTP53RXFP1ALDH1A1NPC1 | |
| SCHEMBL22117098 | 0.81 | SMN1; SMN2 (0.53) | MAPTTP53ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL5017019 | 0.81 | SMN1; SMN2 (0.51) | MAPTTP53ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL29925367 | 0.74 | SMN1; SMN2 (0.48) | MAPTTP53ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL21760981 | 0.73 | ALDH1A1 (0.43) | MAPTALDH1A1PKMSMN1; SMN2NPC1 | |
| SCHEMBL3059986 | 0.72 | MAPT (0.48) | MAPTTP53ALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL1691391 | 0.70 | SMN1; SMN2 (0.49) | MAPTTP53ALDH1A1PKMSMN1; SMN2 | |
| SCHEMBL27362875 | 0.70 | RAB9A (0.56) | MAPTTP53RXFP1ALDH1A1SMN1; SMN2 |
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-2023235753-A2 | ALDH2 INHIBITORS AND METHODS OF USE THEREOF | UNIVERSITY OF MARYLAND, BALTIMORE (US) | 2023-12-07 | — | — | WO | disclosed |