Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | CACNA1B | Q00975 | 6/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 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 | |
|---|---|---|---|---|
| SCHEMBL9681021 | 1.00 | HTT (0.44) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL9680552 | 0.87 | ADORA3 (0.38) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL9680664 | 0.87 | LMNA (0.63) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL9680655 | 0.87 | LMNA (0.63) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL9680661 | 0.87 | LMNA (0.63) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL9680676 | 0.87 | LMNA (0.63) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL8595272 | 0.86 | HTT (0.53) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL8595275 | 0.86 | HTT (0.53) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL9681027 | 0.79 | ADORA3 (0.40) | HTTLMNANR1I2PGRCYP3A4 | |
| SCHEMBL9501988 | 0.74 | LMNA (0.67) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5162345-A | Dihydropyridinedicarboxylate Derivatives | GLAXO, S.P.A. (IT) | 1992-11-10 | — | — | US | disclosed |