Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | GBA1 | P04062 | 2/20 | 0.38 |
| ▸ | KCNA5 | P22460 | 3/20 | 0.37 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.37 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 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 | |
|---|---|---|---|---|
| SCHEMBL28451780 | 0.85 | TSHR (0.49) | POLBMAPTMAPK1GAATSHR | |
| SCHEMBL9763376 | 0.83 | KCNA5 (0.39) | POLBMAPTMAPK1KCNA5KCNN4 | |
| SCHEMBL12072374 | 0.77 | CHRNB2 (0.41) | POLBMAPTMAPK1TAAR1KCNA5 | |
| SCHEMBL28440491 | 0.77 | KCNA5 (0.44) | CHRNA7POLBMAPTMAPK1GAA | |
| SCHEMBL9129445 | 0.74 | CHRNA7 (0.57) | CHRNA7GAATAAR1GBA1KCNA5 | |
| SCHEMBL18590700 | 0.73 | TAAR1 (0.54) | POLBMAPTMAPK1GAATSHR | |
| SCHEMBL14415500 | 0.70 | CHRNB2 (0.42) | CHRNA7KCNA5KCNN4CYP2C19HDAC6 | |
| SCHEMBL11573309 | 0.69 | OPRK1 (0.64) | BCHETAAR1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL3749579 | 0.69 | OPRK1 (0.59) | BCHETAAR1MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL18590701 | 0.68 | GAA (0.53) | POLBMAPTMAPK1GAATSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-110627785-B | Preparation method of 1, 5-tetrahydronaphthyridine derivative | 温州大学 | 2021-06-25 | — | — | CN | disclosed |
| CN-110627785-A | Preparation method of 1, 5-tetrahydronaphthyridine derivative | 温州大学 | 2019-12-31 | — | — | CN | disclosed |