Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | YWHAG | P61981 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.37 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.37 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5173183 | 0.93 | PDE10A (0.49) | PDE10AALDH1A1SMN1; SMN2KDM4EKMT2A | |
| SCHEMBL4811744 | 0.85 | KMT2A (0.44) | PDE10AALDH1A1SMN1; SMN2KDM4EKMT2A | |
| SCHEMBL4811010 | 0.77 | KMT2A (0.44) | PDE10AALDH1A1SMN1; SMN2KDM4EKMT2A | |
| SCHEMBL4815144 | 0.76 | PPARG (0.41) | PDE10AALDH1A1SMN1; SMN2KDM4EKMT2A | |
| SCHEMBL4812552 | 0.73 | PDE10A (0.42) | PDE10AALDH1A1KDM4EKMT2AMEN1 | |
| SCHEMBL4805071 | 0.73 | KMT2A (0.44) | PDE10AALDH1A1KDM4EKMT2AMEN1 | |
| SCHEMBL4809051 | 0.73 | MEN1 (0.44) | PDE10AALDH1A1KDM4EKMT2AMEN1 | |
| SCHEMBL4811052 | 0.72 | CPT1A (0.39) | PPARG | |
| SCHEMBL4809079 | 0.72 | P2RX3 (0.43) | — | |
| SCHEMBL4808748 | 0.70 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2KDM4EHPGDPPARG |
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-7417063-B2 | Bicyclic heterocycles useful as serine protease inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2008-08-26 | — | — | US | claimed |