Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA3 | P07451 | 1/20 | 0.44 |
| ▸ | CA6 | P23280 | 1/20 | 0.44 |
| ▸ | CA5A | P35218 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.44 |
| ▸ | OXTR | P30559 | 1/20 | 0.38 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1616373 | 0.81 | HIF1A (0.54) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL1906156 | 0.79 | KLF10 (0.50) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL364672 | 0.77 | ESR1 (0.53) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL620853 | 0.77 | CA3 (0.44) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL620852 | 0.77 | CA3 (0.44) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL6912849 | 0.77 | CA3 (0.44) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL30041111 | 0.77 | CA3 (0.44) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL2445931 | 0.77 | GABRA1 (0.66) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL146619 | 0.76 | PSEN1 (0.43) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL5694354 | 0.76 | EGFR (0.50) | CA9CA14GABRA1GABRB2IDO1 |
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-117624166-A | Triazole derivative and preparation method and application thereof | 苏州朗睿生物医药有限公司 | 2024-03-01 | — | — | CN | disclosed |
| CN-104822661-A | Novel 5-aminotetrahydroquinoline-2-carboxylic acids and use thereof | Bayer Pharma AG | 2015-08-05 | — | — | CN | disclosed |