Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 1/20 | 0.60 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 5/20 | 0.46 |
| ▸ | AGXT | P21549 | 2/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3902050 | 1.00 | LTA4H (0.60) | LTA4HMAOBALDH1A1LMNAHPGD | |
| SCHEMBL28251912 | 0.86 | LTA4H (0.72) | LTA4HMAOBIDO1CYP11B1CYP11B2 | |
| SCHEMBL2027109 | 0.84 | LTA4H (0.69) | LTA4HMAOBIDO1CYP11B1CYP11B2 | |
| SCHEMBL6160843 | 0.81 | LTA4H (0.60) | LTA4HMAOBALDH1A1LMNAHPGD | |
| SCHEMBL26949212 | 0.81 | LTA4H (0.64) | LTA4HMAOBALDH1A1LMNAHPGD | |
| SCHEMBL28131751 | 0.81 | LTA4H (0.64) | LTA4HMAOBALDH1A1IDO1ATM | |
| SCHEMBL6870361 | 0.81 | DHFR (0.54) | MAOBIDO1AGXTTAAR1 | |
| SCHEMBL31596942 | 0.81 | DHFR (0.54) | MAOBIDO1AGXTTAAR1 | |
| SCHEMBL18613819 | 0.80 | LTA4H (0.58) | LTA4HMAOBALDH1A1IDO1AGXT | |
| SCHEMBL7282070 | 0.79 | LTA4H (0.62) | LTA4HMAOBLMNAHPGDTSHR |
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-117756703-B | Naphthalimide-based coronavirus papain-like protease inhibitors | 广州国家实验室 | 2024-12-10 | — | — | CN | disclosed |
| CN-117756703-A | Naphthalimide-based coronavirus papain-like protease inhibitors | 广州国家实验室 | 2024-03-26 | — | — | CN | disclosed |