Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 7/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.31 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.31 |
| ▸ | F10 | P00742 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7231099 | 0.89 | L3MBTL1 (0.34) | EPHX2MAPTSMN1; SMN2PDK1PDK2 | |
| SCHEMBL7231735 | 0.88 | MMP2 (0.36) | MAPTSMN1; SMN2ALDH1A1POLB | |
| SCHEMBL7230418 | 0.87 | KCNH2 (0.32) | SMN1; SMN2KDM4E | |
| SCHEMBL7231195 | 0.87 | SCN9A (0.37) | EPHX2 | |
| SCHEMBL7233645 | 0.85 | PTPN1 (0.42) | SMN1; SMN2CA2 | |
| SCHEMBL7233323 | 0.84 | ESR1 (0.37) | ALDH1A1 | |
| SCHEMBL7225979 | 0.84 | CHRNA7 (0.41) | MAPTSMN1; SMN2KDM4E | |
| SCHEMBL7224864 | 0.84 | ANO1 (0.35) | TP53MAPTSMN1; SMN2PDK1PDK2 | |
| SCHEMBL7225149 | 0.83 | HTR4 (0.37) | MAPTSMN1; SMN2KDM4EALDH1A1POLB | |
| SCHEMBL7225066 | 0.83 | SLC6A4 (0.41) | KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6562816-B2 | Alpha 7 nicotine acetylcholine receptor agonist anti-psychotic agent, with reduced side effects | PHARMACIA & UPJOHN COMPANY | 2003-05-13 | — | — | US | claimed |
| US-6562816-B2 | Alpha 7 nicotine acetylcholine receptor agonist anti-psychotic agent, with reduced side effects | PHARMACIA & UPJOHN COMPANY | 2003-05-13 | — | — | US | disclosed |