Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE8B | O95263 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | CFTR | P13569 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14428529 | 0.76 | ADORA2B (0.39) | CYP3A4CYP2C9CYP2C19ALDH1A1SMN1; SMN2 | |
| SCHEMBL5383565 | 0.74 | ADORA2B (0.40) | CYP3A4CYP1A2CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL29706732 | 0.71 | HPGD (0.51) | CYP3A4CYP2C9PKMCYP1A2CYP2D6 | |
| SCHEMBL5384192 | 0.69 | ADORA2B (0.38) | ALDH1A1TSHRCFTRSLC6A2SLC6A4 | |
| SCHEMBL5383680 | 0.69 | ADORA2B (0.38) | ALDH1A1TSHRCFTRSLC6A2SLC6A4 | |
| SCHEMBL5384441 | 0.69 | ADORA2B (0.38) | ALDH1A1TSHRCFTRSLC6A2SLC6A4 | |
| SCHEMBL3686055 | 0.68 | CYP11B2 (0.49) | CYP3A4CYP2C9PKMCYP1A2CYP2D6 | |
| SCHEMBL25227851 | 0.68 | KDM4C (0.36) | CYP3A4CYP2C9PKMCYP1A2CYP2D6 | |
| SCHEMBL30397577 | 0.68 | KDM4C (0.36) | CYP3A4CYP2C9PKMCYP1A2CYP2D6 | |
| SCHEMBL25227849 | 0.68 | KDM4C (0.36) | CYP3A4CYP2C9PKMCYP1A2CYP2D6 |
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-5510355-A | ADMINISTERING 2-(3-PYRIDYL)-QUINUCLILIDINE DERIVATIVE TO THE PATIENT UNDERGOING SURGICAL PROCEDURE REQUIRING ANESTHESIA AS A MUSCLE RELEXANT | TARGACEPT, INC., A CORPORATION OF DELAWARE | 1996-04-23 | — | — | US | disclosed |