Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TERT | O14746 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL9836237 | 0.81 | ALDH1A1 (0.41) | CYP2C19ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL9836562 | 0.78 | P2RX7 (0.36) | MEN1KMT2AALDH1A1MAPK1 | |
| SCHEMBL9835913 | 0.78 | P2RX7 (0.36) | KMT2ATERTSMN1; SMN2 | |
| SCHEMBL9835161 | 0.72 | HRH3 (0.38) | DRD2TSHR | |
| SCHEMBL11005428 | 0.72 | CYP2D6 (0.43) | DRD2HTR2ADRD3CYP2C19ACHE | |
| SCHEMBL9836609 | 0.71 | MEN1 (0.41) | MEN1KMT2A | |
| SCHEMBL9836629 | 0.68 | CYP2C19 (0.41) | DRD2HTR2ADRD3CYP2C19MEN1 | |
| SCHEMBL9836996 | 0.67 | MAOA (0.48) | CYP2C19TERTSMN1; SMN2 | |
| SCHEMBL8797476 | 0.67 | MAPT (0.43) | CYP2C19MEN1KMT2AALDH1A1TERT | |
| SCHEMBL8919985 | 0.67 | MEN1 (0.64) | CYP2C19MEN1KMT2AALDH1A1HTT |
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 | claimed |
| US-4547496-A | Antiulcer [1] benzepino[3,4-b]pyridine and compositions | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1985-10-15 | — | — | US | claimed |
| EP-0129879-A2 | A [1] benzepino(3,4-b)pyridine derivative | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1985-01-02 | — | — | EP | claimed |