Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 7/20 | 0.47 |
| ▸ | ITK | Q08881 | 4/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.47 |
| ▸ | HCK | P08631 | 1/20 | 0.39 |
| ▸ | BTK | Q06187 | 1/20 | 0.39 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 4/20 | 0.32 |
| ▸ | RAB9A | P51151 | 4/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
| ▸ | HTR3A | P46098 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.31 |
| ▸ | P2RY1 | P47900 | 2/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 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 | |
|---|---|---|---|---|
| SCHEMBL138318 | 0.72 | LCK (0.66) | LCKITKAURKBHCKBTK | |
| SCHEMBL143491 | 0.69 | LCK (0.49) | LCKITKAURKBHCKBTK | |
| SCHEMBL14243031 | 0.68 | LCK (0.41) | LCKITKAURKBHCKBTK | |
| SCHEMBL136247 | 0.68 | LCK (0.67) | LCKITKAURKBHCKBTK | |
| SCHEMBL16622863 | 0.67 | IDO1 (0.42) | LCKITKAURKBHCKBTK | |
| SCHEMBL10270977 | 0.67 | LCK (0.66) | LCKITKAURKBHCKBTK | |
| SCHEMBL2369709 | 0.66 | NPC1 (0.52) | LCKITKAURKBNPC1RAB9A | |
| SCHEMBL136795 | 0.66 | LCK (0.66) | LCKITKAURKBHCKBTK | |
| SCHEMBL143685 | 0.65 | LCK (0.68) | LCKITKAURKBHCKBTK | |
| SCHEMBL27075924 | 0.65 | ALDH1A1 (0.41) | LCKITKAURKBMEN1KMT2A |
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-2012035055-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-03-22 | — | — | WO | disclosed |