Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 8/20 | 0.41 |
| ▸ | PIK3R1 | P27986 | 6/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10092233 | 0.83 | PIK3CA (0.55) | PIK3CAPIK3R1HTR2CKMT2AALDH1A1 | |
| SCHEMBL6937939 | 0.80 | PIK3R1 (0.47) | PIK3CAPIK3R1CYP2C19PDE10A | |
| SCHEMBL26072464 | 0.78 | PIK3R1 (0.46) | PIK3CAPIK3R1HTR2CMTOR | |
| SCHEMBL10092229 | 0.77 | PIK3CA (0.49) | PIK3CAPIK3R1HTR2CMTOR | |
| SCHEMBL5561919 | 0.77 | HTR2C (0.39) | PIK3CAPIK3R1HTR2CALDH1A1GAA | |
| SCHEMBL5560455 | 0.77 | PIK3CA (0.58) | PIK3CAPIK3R1HTR2CMTOR | |
| SCHEMBL13896920 | 0.77 | PIK3CA (0.45) | PIK3CAPIK3R1HTR2CMTOR | |
| SCHEMBL10092212 | 0.77 | PIK3R1 (0.45) | PIK3CAPIK3R1HTR2CMTOR | |
| SCHEMBL7318610 | 0.77 | CTSK (0.43) | PIK3CAPIK3R1HTR2CALDH1A1KDM4E | |
| SCHEMBL5557353 | 0.76 | PIK3CA (0.44) | PIK3CAPIK3R1CYP2C19ALDH1A1HSD17B10 |
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-2011110545-A1 | IMIDAZO [1, 2 -A] PYRAZINE DERIVATIVES AND THEIR USE FOR THE PREVENTION OR TREATMENT OF NEUROLOGICAL, PSYCHIATRIC AND METABOLIC DISORDERS AND DISEASES | JANSSEN PHARMACEUTICA NV (BE) | 2011-09-15 | — | — | WO | disclosed |