Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT3 | Q9Y243 | 6/20 | 0.40 |
| ▸ | TEC | P42680 | 1/20 | 0.36 |
| ▸ | TXK | P42681 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.36 |
| ▸ | ITK | Q08881 | 1/20 | 0.36 |
| ▸ | TACR3 | P29371 | 10/20 | 0.35 |
| ▸ | TACR2 | P21452 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3471583 | 0.90 | AKT3 (0.43) | AKT3TACR3TACR2TSHRKDM4E | |
| SCHEMBL13638504 | 0.88 | AKT3 (0.48) | AKT3TECTXKBTKITK | |
| SCHEMBL13638565 | 0.88 | AKT3 (0.48) | AKT3TECTXKBTKITK | |
| SCHEMBL16192783 | 0.83 | AKT3 (0.41) | AKT3TECTXKBTKITK | |
| SCHEMBL13638465 | 0.83 | HPGDS (0.47) | AKT3TECTXKBTKITK | |
| SCHEMBL13638295 | 0.82 | AKT3 (0.38) | AKT3TECTXKBTKITK | |
| SCHEMBL13638474 | 0.81 | AKT3 (0.50) | AKT3TECTXKBTKITK | |
| SCHEMBL13638466 | 0.80 | AKT3 (0.62) | AKT3TECTXKBTKITK | |
| SCHEMBL13638569 | 0.79 | AKT3 (0.37) | AKT3TECTXKBTKITK | |
| SCHEMBL14612850 | 0.79 | AKT3 (0.37) | AKT3TECTXKBTKITK |
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 |
|---|---|---|---|---|---|---|---|
| US-7615562-B2 | Such as 2-methyl-4-{5-[2-(2,2,6,6-tetramethyl-piperidin-4-ylamino)-pyrimidin-4-yl]-thiophen-2-yl}-butan-2-ol; tumor necrosis factor inhibitors; immunosuppressants; antiinflammatory agents | NOVARTIS AG (CH) | 2009-11-10 | — | — | US | disclosed |