Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | AR | P10275 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16363563 | 0.84 | ACHE (0.50) | ACHEALDH1A1LMNAHTTTDP1 | |
| SCHEMBL7386225 | 0.83 | ACHE (0.58) | ACHEALDH1A1LMNAHTTTDP1 | |
| SCHEMBL19375277 | 0.82 | ACHE (0.52) | ACHEALDH1A1LMNAHTTTDP1 | |
| SCHEMBL3393561 | 0.81 | ACHE (0.56) | ACHEALDH1A1LMNAHTTTDP1 | |
| SCHEMBL28963146 | 0.80 | ACHE (0.60) | ACHEALDH1A1LMNAHTTTDP1 | |
| SCHEMBL7561328 | 0.79 | ACHE (0.54) | ACHEALDH1A1LMNAHTTTDP1 | |
| SCHEMBL20462014 | 0.79 | ACHE (0.54) | ACHEALDH1A1LMNAHTTTDP1 | |
| SCHEMBL20752042 | 0.79 | ACHE (0.54) | ACHEALDH1A1LMNAHTTTDP1 | |
| SCHEMBL8460171 | 0.79 | ACHE (0.54) | ACHEALDH1A1LMNAHTTTDP1 | |
| SCHEMBL11685732 | 0.77 | ACHE (0.56) | ACHEALDH1A1LMNAHTTTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015092634-A1 | 1,2,3,4-TETRAHYDROISOQUINOLINE COMPOUNDS AND COMPOSITIONS AS SELECTIVE ESTROGEN RECEPTOR ANTAGONISTS AND DEGRADERS | NOVARTIS AG (CH) | 2015-06-25 | — | — | WO | disclosed |