Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.59 |
| ▸ | PGR | P06401 | 1/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.59 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.59 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | DRD3 | P35462 | 1/20 | 0.59 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.59 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.59 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9634339 | 1.00 | HTT (0.59) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL8595500 | 0.85 | LMNA (0.76) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL8595497 | 0.85 | LMNA (0.76) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL10495738 | 0.85 | LMNA (0.76) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL9634733 | 0.82 | CYP3A4 (0.51) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL9632967 | 0.82 | CYP3A4 (0.51) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL9873105 | 0.79 | CYP2C9 (0.74) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL9502762 | 0.79 | LMNA (0.65) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL9502769 | 0.79 | LMNA (0.65) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL9873112 | 0.79 | CYP2C9 (0.74) | HTTLMNANR1I2PGRCYP3A4 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0245919-B1 | 1,4-DIHYDROPYRIDINE DERIVATIVES | GLAXO S.p.A. (IT) | 1992-06-17 | — | — | EP | claimed |
| US-4963571-A | Pyridinedicarboxylic acid derivatives and pharmaceutical compositions | GLAXO S.P.A. (IT) | 1990-10-16 | — | — | US | claimed |
| EP-0245919-A1 | 1,4-Dihydropyridine derivatives | GLAXO S.p.A. (IT) | 1987-11-19 | — | — | EP | claimed |
| EP-0245919-B1 | 1,4-DIHYDROPYRIDINE DERIVATIVES | GLAXO S.p.A. (IT) | 1992-06-17 | — | — | EP | disclosed |
| US-4963571-A | Pyridinedicarboxylic acid derivatives and pharmaceutical compositions | GLAXO S.P.A. (IT) | 1990-10-16 | — | — | US | disclosed |
| US-4806533-A | 1,4-Dihydro pyridine 3,5 dicarboxylic acid derivatives and compositions | GLAXO, S.P.A. (IT) | 1989-02-21 | — | — | US | disclosed |
| EP-0245919-A1 | 1,4-Dihydropyridine derivatives | GLAXO S.p.A. (IT) | 1987-11-19 | — | — | EP | disclosed |