Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.69 |
| ▸ | RAB9A | P51151 | 4/20 | 0.69 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.66 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.66 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.66 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.66 |
| ▸ | PARP1 | P09874 | 1/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.60 |
| ▸ | GAA | P10253 | 3/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.60 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL21275460 | 0.88 | RAB9A (0.76) | NPC1RAB9ACHRNB2CHRNB4CHRNA3 | |
| Naptalam SCHEMBL8537412 | 0.83 | HSD17B10 (0.74) | NPC1RAB9ACHRNB2CHRNB4CHRNA3 | |
| Naptalam SCHEMBL29469565 | 0.83 | HSD17B10 (0.74) | NPC1RAB9ACHRNB2CHRNB4CHRNA3 | |
| Naptalam SCHEMBL54940 | 0.83 | HSD17B10 (0.74) | NPC1RAB9ACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL331600 | 0.83 | NPC1 (0.69) | NPC1RAB9ACHRNB2CHRNB4CHRNA3 | |
| Naptalam SCHEMBL29610802 | 0.83 | HSD17B10 (0.74) | NPC1RAB9ACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL23706458 | 0.82 | NPC1 (1.00) | NPC1RAB9ACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL6357071 | 0.82 | PTGES (0.76) | NPC1RAB9ACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL21829030 | 0.82 | NPC1 (0.68) | NPC1RAB9ACHRNB2CHRNB4CHRNA3 | |
| SCHEMBL4926868 | 0.82 | KDM4E (0.72) | NPC1RAB9ACHRNB2CHRNB4CHRNA3 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117466799-B | N-substituted phthalic acid diamide preparation method of imine compound | 西北师范大学 | 2024-12-24 | — | — | CN | claimed |
| CN-117466799-A | Preparation method of N-substituted phthalimide compound | 西北师范大学 | 2024-01-30 | — | — | CN | claimed |
| CN-104163799-B | 3-amino-4-Cyanoisoquinoline-1(2H) preparation method of-one derivant | 苏州大学 | 2016-08-17 | — | — | CN | claimed |
| CN-117466799-B | N-substituted phthalic acid diamide preparation method of imine compound | 西北师范大学 | 2024-12-24 | — | — | CN | disclosed |
| CN-117466799-A | Preparation method of N-substituted phthalimide compound | 西北师范大学 | 2024-01-30 | — | — | CN | disclosed |
| CN-104163799-B | 3-amino-4-Cyanoisoquinoline-1(2H) preparation method of-one derivant | 苏州大学 | 2016-08-17 | — | — | CN | disclosed |
| CN-105294597-A | Benzothiazine derivative, and synthetic method and application thereof | UNIV EAST CHINA NORMAL | 2016-02-03 | — | — | CN | disclosed |