Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | AR | P10275 | 1/20 | 0.46 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6702861 | 0.91 | ALDH1A1 (0.49) | ALDH1A1MAPTTDP1SMN1; SMN2GPBAR1 | |
| SCHEMBL6232024 | 0.86 | AR (0.50) | ALDH1A1LMNAMAPTTDP1SMN1; SMN2 | |
| SCHEMBL6238955 | 0.85 | SMN1; SMN2 (0.47) | ALDH1A1LMNAMAPTTDP1SMN1; SMN2 | |
| SCHEMBL18601076 | 0.83 | KMT2A (0.50) | ALDH1A1LMNATDP1SMN1; SMN2AR | |
| SCHEMBL6232985 | 0.80 | PARP10 (0.62) | ALDH1A1MAPTKMT2AMEN1MAOB | |
| SCHEMBL18600769 | 0.80 | HTT (0.46) | ALDH1A1LMNAMAPTTDP1SMN1; SMN2 | |
| SCHEMBL18600867 | 0.79 | AR (0.44) | ALDH1A1LMNAMAPTTDP1SMN1; SMN2 | |
| SCHEMBL2362378 | 0.77 | MAOA (0.58) | ALDH1A1LMNAMAPTTDP1SMN1; SMN2 | |
| SCHEMBL6685562 | 0.77 | ALDH1A1 (0.57) | ALDH1A1LMNAMAPTTDP1SMN1; SMN2 | |
| SCHEMBL3219291 | 0.77 | ALDH1A1 (0.54) | ALDH1A1LMNAMAPTTDP1SMN1; 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 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 |