Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PTP4A3 | O75365 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6685562 | 0.87 | ALDH1A1 (0.57) | RAB9ASMN1; SMN2MAPTNPC1ALDH1A1 | |
| SCHEMBL6233564 | 0.84 | LMNA (0.53) | DHODHRAB9ASMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL5096222 | 0.82 | MAPT (0.70) | RAB9ASMN1; SMN2MAPTNPC1ALDH1A1 | |
| SCHEMBL2362378 | 0.82 | MAOA (0.58) | RAB9ASMN1; SMN2MAPTNPC1ALDH1A1 | |
| SCHEMBL4909005 | 0.82 | SMN1; SMN2 (0.57) | RAB9ASMN1; SMN2MAPTALDH1A1KMT2A | |
| SCHEMBL275398 | 0.80 | RAB9A (0.48) | DHODHRAB9ASMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL15774835 | 0.78 | MAOA (0.63) | RAB9ASMN1; SMN2NPC1ALDH1A1NFKB1 | |
| SCHEMBL6702861 | 0.78 | ALDH1A1 (0.49) | RAB9ASMN1; SMN2MAPTNPC1ALDH1A1 | |
| SCHEMBL6234745 | 0.77 | ALDH1A1 (0.62) | RAB9ASMN1; SMN2MAPTNPC1ALDH1A1 | |
| SCHEMBL15774354 | 0.76 | CISD1 (0.58) | RAB9ASMN1; SMN2MAPTNPC1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2005000309-A2 | CHEMICAL COMPOUNDS | IONIX PHARMACEUTICALS LIMITED (GB) | 2005-01-06 | — | — | WO | disclosed |
| WO-2004087125-A1 | AMINO ACID DERIVATIVES AS INHIBITORS OF MAMMALIAN SODIUM CHANNELS | IONIX PHARMACEUTICALS LIMITED (GB) | 2004-10-14 | — | — | WO | disclosed |