Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.34 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | AOC1 | P19801 | 4/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 4/20 | 0.33 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CCNC | P24863 | 1/20 | 0.33 |
| ▸ | CDK8 | P49336 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23580328 | 0.85 | NOS1 (0.39) | ADAMTS4SIRT3TDP1NOTUMMEN1 | |
| SCHEMBL31336994 | 0.85 | NOS1 (0.39) | ADAMTS4SIRT3TDP1NOTUMMEN1 | |
| SCHEMBL4057138 | 0.81 | SIRT3 (0.36) | SIRT3TDP1AOC1AOC3GPR119 | |
| SCHEMBL873728 | 0.76 | CYP2E1 (0.49) | TDP1AOC1AOC3CYP2E1CYP2C8 | |
| SCHEMBL214076 | 0.76 | — | — | |
| SCHEMBL6628774 | 0.75 | TKT (0.39) | SIRT3TDP1AOC1AOC3GPR119 | |
| SCHEMBL14945019 | 0.75 | TAAR1 (0.52) | SIRT3TDP1AOC1AOC3CYP2E1 | |
| SCHEMBL26194330 | 0.74 | GAA (0.35) | CYP2C19 | |
| SCHEMBL1448227 | 0.74 | — | — | |
| SCHEMBL21983945 | 0.73 | TAAR1 (0.50) | NOTUM |
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-117597337-A | Process for the preparation of antibacterial compounds | 迪斯库瓦有限公司 | 2024-02-23 | — | — | CN | disclosed |