Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.41 |
| ▸ | CACNA1B | Q00975 | 12/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10778133 | 1.00 | AKR1C3 (0.42) | AKR1C3LMNACYP3A4ADORA3CYP2C9 | |
| SCHEMBL10778144 | 1.00 | AKR1C3 (0.42) | AKR1C3LMNACYP3A4ADORA3CYP2C9 | |
| SCHEMBL9524555 | 0.85 | BRD4 (0.41) | LMNACYP3A4ADORA3CYP2C9TBXAS1 | |
| SCHEMBL9524567 | 0.85 | BRD4 (0.41) | LMNACYP3A4ADORA3CYP2C9TBXAS1 | |
| SCHEMBL9524561 | 0.85 | BRD4 (0.41) | LMNACYP3A4ADORA3CYP2C9TBXAS1 | |
| SCHEMBL10772083 | 0.85 | ADORA3 (0.49) | LMNACYP3A4ADORA3CYP2C9TBXAS1 | |
| SCHEMBL9680643 | 0.85 | ADORA3 (0.60) | LMNACYP3A4ADORA3CYP2C9TBXAS1 | |
| SCHEMBL9680632 | 0.85 | ADORA3 (0.60) | LMNACYP3A4ADORA3CYP2C9TBXAS1 | |
| SCHEMBL9680646 | 0.85 | ADORA3 (0.60) | LMNACYP3A4ADORA3CYP2C9TBXAS1 | |
| SCHEMBL10772073 | 0.85 | ADORA3 (0.49) | LMNACYP3A4ADORA3CYP2C9TBXAS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0226271-A1 | 1,4-Dihydropyridine compounds and their preparation and pharmaceutical formulation | GLAXO S.p.A. (IT) | 1987-06-24 | — | — | EP | disclosed |