Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 5/20 | 0.48 |
| ▸ | NOS2 | P35228 | 5/20 | 0.48 |
| ▸ | NOS1 | P29475 | 3/20 | 0.48 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.31 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | MTOR | P42345 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL30868123 | 0.81 | VRK1 (0.31) | — | |
| SCHEMBL29704112 | 0.80 | NOS3 (0.56) | NOS3NOS2NOS1MAP4K4AGBL2 | |
| SCHEMBL6985744 | 0.80 | NOS3 (0.56) | NOS3NOS2NOS1MAP4K4AGBL2 | |
| SCHEMBL5958671 | 0.74 | POLB (0.48) | POLBALDH1A1SMN1; SMN2 | |
| SCHEMBL10202034 | 0.74 | NOS3 (0.58) | NOS3NOS2NOS1MAP4K4POLB | |
| SCHEMBL23478917 | 0.71 | NOS3 (0.54) | NOS3NOS2NOS1MAP4K4POLB | |
| SCHEMBL3910479 | 0.69 | CYP3A4 (0.45) | KDM4EALDH1A1GAASMN1; SMN2 | |
| SCHEMBL16337619 | 0.69 | MAP4K4 (0.31) | NOS3NOS2MAP4K4POLBKDM4E | |
| SCHEMBL11629806 | 0.68 | ALDH1A1 (0.41) | POLBKDM4ENPC1ALDH1A1GAA | |
| SCHEMBL698233 | 0.68 | POLB (0.46) | POLBALDH1A1SMN1; 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-2024028169-A1 | NOVEL SPECIFICALLY SUBSTITUTED THIOPHENOLIC COMPOUNDS | NERVIANO MEDICAL SCIENCES S.R.L. (IT) | 2024-02-08 | — | — | WO | disclosed |