Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | SLC10A1 | Q14973 | 8/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL25645199 | 0.87 | TSHR (0.46) | TSHRLMNALRRK2MAPTRAB9A | |
| SCHEMBL24061312 | 0.84 | SLC10A1 (0.44) | TSHRLMNALRRK2MAPTRAB9A | |
| SCHEMBL21427900 | 0.84 | SLC10A1 (0.44) | TSHRLMNALRRK2MAPTRAB9A | |
| SCHEMBL28486712 | 0.84 | SLC10A1 (0.44) | TSHRLMNALRRK2MAPTRAB9A | |
| SCHEMBL29625072 | 0.84 | SLC10A1 (0.44) | TSHRLMNALRRK2MAPTRAB9A | |
| SCHEMBL28898136 | 0.82 | SLC10A1 (0.42) | LRRK2GRM4SLC10A1 | |
| SCHEMBL28898134 | 0.82 | SLC10A1 (0.42) | TSHRLMNALRRK2MAPTGRM4 | |
| SCHEMBL23169134 | 0.81 | TSHR (0.46) | TSHRLMNALRRK2MAPTRAB9A | |
| SCHEMBL28898130 | 0.80 | SLC10A1 (0.41) | LRRK2GRM4SLC10A1 | |
| SCHEMBL28898138 | 0.80 | GRM4 (0.39) | TSHRLMNALRRK2MAPTGRM4 |
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-114466837-B | Crystal form of N-heterocyclic five-membered ring compound and application thereof | 正大天晴药业集团股份有限公司 | 2024-05-31 | — | — | CN | disclosed |
| CN-113365979-B | Capsid protein assembly inhibitor containing N-hetero five-membered ring, pharmaceutical composition and use thereof | 正大天晴药业集团股份有限公司 | 2023-09-22 | — | — | CN | disclosed |
| CN-111868026-B | Capsid protein assembly inhibitor containing N-heterocyclic five-membered ring, pharmaceutical composition and application thereof | 正大天晴药业集团股份有限公司 | 2022-11-25 | — | — | CN | disclosed |