Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | PDCD1LG2 | Q9BQ51 | 2/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23879248 | 1.00 | TAS1R3 (0.38) | TAS1R3TAS1R1TAS1R2HPGDLMNA | |
| SCHEMBL23879282 | 0.87 | LMNA (0.37) | HPGDLMNAKMT2ANPC1RAB9A | |
| SCHEMBL30452496 | 0.87 | LMNA (0.37) | HPGDLMNAKMT2ANPC1RAB9A | |
| SCHEMBL28420887 | 0.83 | TAS1R3 (0.38) | TAS1R3TAS1R1TAS1R2HPGDLMNA | |
| SCHEMBL30452538 | 0.81 | ALDH1A1 (0.51) | TAS1R3TAS1R1TAS1R2HPGDLMNA | |
| SCHEMBL23879255 | 0.81 | ALDH1A1 (0.51) | TAS1R3TAS1R1TAS1R2HPGDLMNA | |
| SCHEMBL23879281 | 0.78 | ALDH1A1 (0.43) | TAS1R3TAS1R1TAS1R2LMNAHTT | |
| SCHEMBL30453150 | 0.78 | ALDH1A1 (0.43) | TAS1R3TAS1R1TAS1R2LMNAHTT | |
| SCHEMBL24252077 | 0.76 | TAS1R3 (0.47) | TAS1R3TAS1R1TAS1R2HPGDLMNA | |
| SCHEMBL23879259 | 0.74 | GAA (0.43) | LMNAHTTKMT2AGAAMAPT |
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-111253404-B | Nitrogen-containing heterocyclic compound and composition, preparation method and application thereof | 上海医药集团股份有限公司 | 2023-05-23 | — | — | CN | disclosed |