Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL25414944 | 0.85 | APP (0.69) | MEN1LMNASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11055510 | 0.84 | ESR1 (0.45) | HRH3CA2HSD17B14PIN1 | |
| SCHEMBL27527069 | 0.80 | HSD17B14 (0.46) | HRH3ALDH1A1GLAKDM4EGAA | |
| SCHEMBL857068 | 0.79 | HSD17B14 (0.41) | ALDH1A1GLAKDM4EGAACA1 | |
| SCHEMBL26086659 | 0.79 | HSD17B14 (0.41) | ALDH1A1GLAKDM4EGAACA1 | |
| SCHEMBL1996329 | 0.77 | NQO2 (0.50) | MEN1LMNAKMT2AALDH1A1GLA | |
| SCHEMBL29392214 | 0.77 | NQO2 (0.50) | MEN1LMNAKMT2AALDH1A1GLA | |
| SCHEMBL13074509 | 0.77 | CYP2A6 (0.50) | F2SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL27602631 | 0.77 | CYP11B1 (0.39) | ALDH1A1GLAKDM4EGAACA1 | |
| SCHEMBL11422378 | 0.77 | ALDH1A1 (0.58) | HRH3ACHEMEN1KMT2AALDH1A1 |
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-115232160-A | Heteroatom-containing spiro derivative and application thereof | 棓诺(苏州)新材料有限公司 | 2022-10-25 | — | — | CN | disclosed |