Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | PARP1 | P09874 | 6/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.37 |
| ▸ | RELA | Q04206 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8516474 | 0.97 | RAB9A (0.40) | RAB9AAURKAIKBKBPARP1HTT | |
| SCHEMBL8516645 | 0.80 | RAB9A (0.42) | RAB9AIKBKBPARP1HTTMAPK8 | |
| SCHEMBL29771871 | 0.80 | IKBKB (0.49) | AURKAIKBKBPARP1ALDH1A1MAPT | |
| SCHEMBL29437046 | 0.79 | IKBKB (0.47) | AURKAIKBKBPARP1ALDH1A1MAPT | |
| SCHEMBL3783665 | 0.75 | PARP1 (0.50) | AURKAIKBKBPARP1ALDH1A1MAPT | |
| SCHEMBL3787229 | 0.75 | PARP1 (0.48) | AURKAIKBKBPARP1ALDH1A1MAPT | |
| SCHEMBL30300429 | 0.75 | BCAT2 (0.54) | RAB9AHTTMAPK8ALDH1A1NPC1 | |
| SCHEMBL8516798 | 0.74 | FGFR1 (0.45) | AURKAPARP1HTTPOLBESR2 | |
| SCHEMBL28639355 | 0.74 | CHUK (0.42) | IKBKBALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL407835 | 0.73 | BCAT2 (0.55) | IKBKBPARP1ALDH1A1MAPTCYP1A2 |
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-1999052857-A1 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM PLC (GB) | 1999-10-21 | — | — | WO | disclosed |