Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | THPO | P40225 | 1/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21692378 | 0.85 | GRM4 (0.40) | ALDH1A1GAACES2BCHECES1 | |
| SCHEMBL17952751 | 0.81 | MAOA (0.37) | ALDH1A1CES1GRM4HTTCYP1A2 | |
| SCHEMBL21929610 | 0.80 | ATR (0.37) | ALDH1A1GAACES2BCHECES1 | |
| SCHEMBL21927228 | 0.79 | ATR (0.36) | ALDH1A1GAACES2BCHECES1 | |
| SCHEMBL21929622 | 0.78 | PDE10A (0.40) | ALDH1A1GAACES2BCHECES1 | |
| SCHEMBL21929612 | 0.77 | UCHL1 (0.40) | ALDH1A1GAACES2BCHECES1 | |
| SCHEMBL21692243 | 0.76 | HPGD (0.40) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL21693057 | 0.76 | P2RX4 (0.37) | NPSR1HTTCYP1A2CYP17A1SMN1; SMN2 | |
| SCHEMBL21693361 | 0.76 | CYP1A2 (0.47) | ALDH1A1GAABCHECYP1A2CYP3A4 | |
| SCHEMBL18624471 | 0.76 | PDE6D (0.44) | ALDH1A1GAAGRM4HTTCYP1A2 |
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-3247771-B1 | PYRIDINES AND DERIVATIVES THEREOF AS COMPONENTS FOR USE IN OPTOELECTRONIC COMPONENTS | CYNORA GMBH (DE) | 2020-06-10 | — | — | EP | disclosed |
| US-10544361-B2 | Pyridines and derivatives thereof as components for use in optoelectronic components | CYNORA GMBH (DE) | 2020-01-28 | — | — | US | disclosed |