Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 12/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9836562 | 0.83 | P2RX7 (0.36) | ALDH1A1LMNAP2RX7MAPTCYP3A4 | |
| SCHEMBL9835913 | 0.82 | P2RX7 (0.36) | LMNASMN1; SMN2P2RX7MAPT | |
| SCHEMBL9836786 | 0.81 | DRD2 (0.43) | ALDH1A1HTTSMN1; SMN2CYP2C19 | |
| SCHEMBL9836629 | 0.74 | CYP2C19 (0.41) | ALDH1A1LMNACYP1A2CYP2C19 | |
| SCHEMBL9836996 | 0.73 | MAOA (0.48) | LMNASMN1; SMN2P2RX7MAPTCYP1A2 | |
| SCHEMBL8797476 | 0.73 | MAPT (0.43) | ALDH1A1LMNASMN1; SMN2P2RX7MAPT | |
| SCHEMBL9835161 | 0.72 | HRH3 (0.38) | — | |
| SCHEMBL9834971 | 0.72 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL9835174 | 0.72 | MAPK14 (0.38) | ALDH1A1SMN1; SMN2MAPTCYP1A2CYP3A4 | |
| SCHEMBL9835877 | 0.71 | GRIN1 (0.42) | ALDH1A1LMNASMN1; SMN2CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0129879-B1 | A [1] benzepino(3,4-b)pyridine derivative | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1991-09-11 | — | — | EP | disclosed |
| US-4547496-A | Antiulcer [1] benzepino[3,4-b]pyridine and compositions | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1985-10-15 | — | — | US | disclosed |
| EP-0129879-A2 | A [1] benzepino(3,4-b)pyridine derivative | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1985-01-02 | — | — | EP | disclosed |