Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SORT1 | Q99523 | 7/20 | 0.57 |
| ▸ | GRN | P28799 | 6/20 | 0.57 |
| ▸ | MARS1 | P56192 | 2/20 | 0.53 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | CRACR2A | Q9BSW2 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22637715 | 1.00 | SORT1 (0.57) | SORT1GRNMARS1KLKB1CYP1A2 | |
| SCHEMBL4134838 | 0.87 | GRN (0.74) | SORT1GRNKLKB1POLBTSHR | |
| SCHEMBL22637502 | 0.84 | GRN (0.59) | SORT1GRNMARS1KLKB1NPSR1 | |
| SCHEMBL22637209 | 0.84 | SMN1; SMN2 (0.52) | SORT1GRNCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL27727953 | 0.77 | GRN (0.47) | SORT1GRNKLKB1CYP1A2CYP3A4 | |
| SCHEMBL29008667 | 0.76 | GRN (0.76) | SORT1GRNKLKB1POLBTSHR | |
| SCHEMBL2688186 | 0.75 | GRN (0.57) | SORT1GRNKLKB1NPSR1GAA | |
| SCHEMBL3069753 | 0.73 | GRN (1.00) | SORT1GRNCYP1A2CYP2D6CYP2C9 | |
| SCHEMBL4253961 | 0.72 | PTGS2 (0.51) | CYP1A2CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL19779588 | 0.72 | CCR9 (0.51) | SORT1GRNKLKB1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114269340-A | KCNT1 inhibitors and methods of use | 普拉克西斯精密药物股份有限公司 | 2022-04-01 | — | — | CN | disclosed |