Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.48 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.44 |
| ▸ | FLT3 | P36888 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | DAO | P14920 | 2/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | DDO | Q99489 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3608256 | 1.00 | AOC3 (0.48) | AOC3BRD4RAB9ANPC1LOXL2 | |
| SCHEMBL30559750 | 1.00 | AOC3 (0.48) | AOC3BRD4RAB9ANPC1LOXL2 | |
| SCHEMBL15791226 | 0.83 | AOC3 (0.45) | AOC3BRD4RAB9ANPC1LOXL2 | |
| SCHEMBL17546182 | 0.80 | KDM4E (0.46) | AOC3BRD4RAB9ANPC1LOXL2 | |
| SCHEMBL7019205 | 0.79 | AOC3 (0.45) | AOC3BRD4RAB9ANPC1LOXL2 | |
| SCHEMBL19557306 | 0.78 | ALDH1A1 (0.47) | AOC3BRD4RAB9ANPC1LOXL2 | |
| 2-Methylindole SCHEMBL12420 | 0.70 | BRD4 (0.57) | AOC3BRD4RAB9ANPC1LOXL2 | |
| 2-Methylindole SCHEMBL29377448 | 0.70 | BRD4 (0.57) | AOC3BRD4RAB9ANPC1LOXL2 | |
| SCHEMBL1854303 | 0.69 | CYP2A6 (0.58) | AOC3BRD4RAB9ANPC1LOXL2 | |
| SCHEMBL10479143 | 0.69 | AOC3 (0.44) | AOC3BRD4RAB9ANPC1LOXL2 |
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-116829550-A | Pyrimidine-2-ylsulfonamide derivatives | 豪夫迈·罗氏有限公司 | 2023-09-29 | — | — | CN | disclosed |