Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 3/20 | 0.36 |
| ▸ | NOS2 | P35228 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | HEXA | P06865 | 1/20 | 0.30 |
| ▸ | HEXB | P07686 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12515037 | 0.84 | ALDH1A1 (0.43) | NOS3NOS2ALDH1A1KDM4ELMNA | |
| SCHEMBL25162110 | 0.77 | ALDH1A1 (0.48) | NOS3NOS2ALDH1A1KDM4ELMNA | |
| SCHEMBL6905386 | 0.76 | NOS3 (0.38) | NOS3NOS2ALDH1A1KDM4ELMNA | |
| SCHEMBL11148575 | 0.71 | ALDH1A1 (0.41) | NOS3NOS2ALDH1A1KDM4ELMNA | |
| SCHEMBL423627 | 0.69 | ALDH1A1 (0.37) | NOS3NOS2ALDH1A1KDM4EMAPT | |
| SCHEMBL28794153 | 0.65 | ALDH1A1 (0.39) | NOS3NOS2ALDH1A1KDM4ETSHR | |
| SCHEMBL2140622 | 0.64 | NOS3 (0.38) | NOS3NOS2GAATP53SMN1; SMN2 | |
| SCHEMBL9579926 | 0.64 | SELL (0.52) | ALDH1A1KDM4ELMNAGAAMAPT | |
| Ammonia Solution, Strong SCHEMBL3636757 | 0.64 | ALDH1A1 (0.43) | NOS3NOS2ALDH1A1KDM4ELMNA | |
| SCHEMBL24158149 | 0.64 | ALDH1A1 (0.34) | ALDH1A1KDM4ELMNAGAAMAPT |
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-2024141757-A1 | LSD1 MODULATORS | EXSCIENTIA AI LIMITED (GB) | 2024-07-04 | — | — | WO | disclosed |