Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | F2 | P00734 | 1/20 | 0.30 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | ADORA3 | P0DMS8 | 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 | |
|---|---|---|---|---|
| SCHEMBL3863140 | 1.00 | CASP1 (0.37) | CASP1CASP7HSD17B10MAPTLMNA | |
| SCHEMBL7659749 | 0.84 | MEN1 (0.34) | CASP1CASP7HSD17B10MAPTLMNA | |
| SCHEMBL7938077 | 0.76 | ADRA2A (0.34) | MAPTKDM4EALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL1962410 | 0.76 | PNMT (0.36) | ADRA2A | |
| SCHEMBL9573469 | 0.76 | DRD2 (0.37) | HSD17B10CA9MAOADRD1DRD3 | |
| SCHEMBL9573203 | 0.76 | CYP19A1 (0.33) | KMT2AADRA2AACHESLC6A4 | |
| SCHEMBL30025550 | 0.76 | ADRA2A (0.34) | MAPTKDM4EALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL28191945 | 0.76 | — | — | |
| SCHEMBL9573205 | 0.76 | HTR2A (0.38) | ADRA2AACHEHTT | |
| Hydrochloric Acid SCHEMBL11820690 | 0.74 | ADRA2A (0.33) | ALDH1A1ADRA2AACHE |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117946093-A | Compounds useful as HPK1 inhibitors | 深圳福沃药业有限公司 | 2024-04-30 | — | — | CN | disclosed |
| WO-2023109909-A1 | AROMATIC HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR AND USES THEREOF | 上海翊石医药科技有限公司 | 2023-06-22 | — | — | WO | disclosed |
| CN-115557933-A | Bruton tyrosine kinase and mutant degradation agent, composition and application thereof | 杭州和正医药有限公司 | 2023-01-03 | — | — | CN | disclosed |
| CN-114751874-A | 1-benzyl-4-ethylpiperazine derivatives as TRPV4-KCa2.3 coupling promoting agents and application thereof | 江南大学 | 2022-07-15 | — | — | CN | disclosed |