Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 4/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | METAP1 | P53582 | 2/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22796908 | 1.00 | SLC6A2 (0.34) | SLC6A2SLC6A4SLC6A3HSD17B10L3MBTL1 | |
| SCHEMBL8340988 | 0.85 | SLC6A2 (0.36) | SLC6A2SLC6A4SLC6A3HSD17B10ALDH1A1 | |
| SCHEMBL29809640 | 0.83 | HSD17B3 (0.40) | SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL29557840 | 0.83 | HSD17B3 (0.40) | SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL24372388 | 0.81 | NOTUM (0.36) | L3MBTL1ALDH1A1ACHE | |
| SCHEMBL29809349 | 0.79 | ALDH1A1 (0.34) | SLC6A2SLC6A4SLC6A3L3MBTL1ALDH1A1 | |
| SCHEMBL29809465 | 0.79 | BRD4 (0.37) | ALDH1A1CYP1A2 | |
| SCHEMBL23346753 | 0.79 | KDM4E (0.34) | ALDH1A1 | |
| SCHEMBL23506053 | 0.79 | ADRA2A (0.31) | — | |
| SCHEMBL21304054 | 0.77 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114805204-B | Method for preparing 4-iodoisoquinoline-1 (2H) -ketone compound | 云南师范大学 | 2023-09-15 | — | — | CN | claimed |
| CN-114805204-B | Method for preparing 4-iodoisoquinoline-1 (2H) -ketone compound | 云南师范大学 | 2023-09-15 | — | — | CN | disclosed |
| CN-114805204-A | Method for preparing 4-iodoisoquinoline-1 (2H) -ketone compound | 云南师范大学 | 2022-07-29 | — | — | CN | disclosed |