Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 6/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | NOX1 | Q9Y5S8 | 10/20 | 0.41 |
| ▸ | GAA | P10253 | 7/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | SNCA | P37840 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4510651 | 0.81 | GAA (0.52) | MEN1KMT2AALDH1A1KDM4EHPGD | |
| SCHEMBL8558177 | 0.81 | NOX1 (0.58) | MEN1KMT2AHPGDNOX1GAA | |
| SCHEMBL8558747 | 0.80 | NOX1 (0.61) | MEN1KMT2AHTTALDH1A1NOX1 | |
| SCHEMBL225829 | 0.74 | NOX1 (0.65) | MEN1KMT2AHTTALDH1A1NOX1 | |
| SCHEMBL4731236 | 0.74 | ALDH1A1 (0.53) | MEN1KMT2AHTTALDH1A1KDM4E | |
| SCHEMBL125602 | 0.74 | ALDH1A1 (0.61) | MEN1KMT2AHTTALDH1A1KDM4E | |
| SCHEMBL29829120 | 0.74 | ALDH1A1 (0.61) | MEN1KMT2AHTTALDH1A1KDM4E | |
| SCHEMBL28639550 | 0.73 | ALDH1A1 (0.59) | MEN1KMT2AHTTALDH1A1KDM4E | |
| SCHEMBL8562468 | 0.71 | NOX1 (0.58) | MEN1KMT2AHPGDNOX1GAA | |
| SCHEMBL8561569 | 0.71 | MEN1 (0.47) | MEN1KMT2AALDH1A1KDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0640592-B1 | N-acylated tricyclic azaheterorings useful as vasopressin antagonists | AMERICAN CYANAMID CO (US) | 1998-12-30 | — | — | EP | disclosed |
| EP-0640592-A1 | N-acylated tricyclic azaheterorings useful as vasopressin antagonists | AMERICAN CYANAMID COMPANY (US) | 1995-03-01 | — | — | EP | disclosed |