Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 10/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | BTK | Q06187 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL29249786 | 0.90 | CA12 (0.43) | NPC1RAB9AFFAR1BTKCA12 | |
| SCHEMBL29249778 | 0.89 | APP (0.37) | NPC1RAB9AFFAR1BTKCHRM2 | |
| SCHEMBL29249801 | 0.89 | LMNA (0.43) | NPC1RAB9ANPSR1KDM4EALDH1A1 | |
| SCHEMBL29249803 | 0.87 | ACACB (0.38) | NPC1RAB9ANPSR1FFAR1MEN1 | |
| SCHEMBL29249785 | 0.87 | PTGDR2 (0.42) | CYP3A4CYP2C9BTK | |
| SCHEMBL29249830 | 0.87 | BCL2A1 (0.46) | NPC1RAB9ALMNAFFAR1MEN1 | |
| SCHEMBL31092720 | 0.86 | CHRNB2 (0.42) | FFAR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL29249794 | 0.86 | PTPN1 (0.38) | FFAR1BTKPTPN1 | |
| SCHEMBL29249784 | 0.86 | CHRNB2 (0.42) | FFAR1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL29249773 | 0.85 | FFAR1 (0.38) | NPC1RAB9ANPSR1KDM4EALDH1A1 |
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-118324695-A | Method for selectively preparing quinoline-2-ketone or 3, 4-dihydro-quinoline-2-ketone compound under regulation of photocatalyst | 浙江工业大学 | 2024-07-12 | — | — | CN | disclosed |