Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28815924 | 1.00 | RAB9A (0.59) | RAB9AKDM4EHSD17B10TSHRPKM | |
| SCHEMBL30410550 | 0.90 | RAB9A (0.56) | RAB9AKDM4EHSD17B10TSHRPKM | |
| SCHEMBL23606684 | 0.80 | ALDH1A1 (0.66) | RAB9AKDM4EHSD17B10RECQLALDH1A1 | |
| SCHEMBL24164236 | 0.76 | TSHR (0.48) | RAB9AKDM4EHSD17B10TSHRPKM | |
| SCHEMBL2266526 | 0.75 | RAB9A (1.00) | RAB9AKDM4EHSD17B10TSHRPKM | |
| SCHEMBL29624740 | 0.75 | RAB9A (1.00) | RAB9AKDM4EHSD17B10TSHRPKM | |
| SCHEMBL12824128 | 0.71 | KMT2A (0.45) | RAB9AHSD17B10TSHRPKMALDH1A1 | |
| SCHEMBL5801394 | 0.70 | KDM4E (1.00) | RAB9AKDM4EHSD17B10TSHRPKM | |
| SCHEMBL22432547 | 0.70 | RAB9A (0.45) | RAB9AKDM4EHSD17B10TSHRPKM | |
| SCHEMBL13085156 | 0.69 | RECQL (0.71) | RAB9AKDM4EHSD17B10TSHRPKM |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118930483-A | Synthesis method of isoquinolone selenocyanate | 新疆大学 | 2024-11-12 | — | — | CN | claimed |
| CN-118930483-A | Synthesis method of isoquinolone selenocyanate | 新疆大学 | 2024-11-12 | — | — | CN | disclosed |
| CN-114920740-B | 5, 6-Dihydrobenzo [4,5] imidazo [2,1-a ] isoquinoline compound and preparation method and application thereof | 杭州医学院 | 2024-05-28 | — | — | CN | disclosed |
| CN-114874229-B | 5, 6-dihydro-benzimidazol isoquinoline spiro lactone compound and synthetic method and application thereof | 杭州医学院 | 2023-07-18 | — | — | CN | disclosed |
| CN-114920740-A | 5, 6-dihydrobenzo [4,5] imidazo [2,1-a ] isoquinoline compound and preparation method and application thereof | 杭州医学院 | 2022-08-19 | — | — | CN | disclosed |
| CN-114874229-A | 5, 6-dihydrobenzimidazoisoquinoline spiro lactone compound and synthesis method and application thereof | 杭州医学院 | 2022-08-09 | — | — | CN | disclosed |