Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 6/20 | 0.50 |
| ▸ | L3MBTL3 | Q96JM7 | 4/20 | 0.50 |
| ▸ | TP53BP1 | Q12888 | 2/20 | 0.50 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | ACACB | O00763 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29965459 | 1.00 | CYP1A2 (0.57) | CYP1A2CYP2D6SMN1; SMN2HTTMAPT | |
| Hydrochloric Acid SCHEMBL23199837 | 0.99 | CYP1A2 (0.56) | CYP1A2CYP2D6SMN1; SMN2HTTMAPT | |
| Trifluoroacetic Acid SCHEMBL31198255 | 0.93 | CYP1A2 (0.50) | CYP1A2CYP2D6SMN1; SMN2HTTMAPT | |
| SCHEMBL31323039 | 0.90 | SMN1; SMN2 (0.66) | CYP1A2CYP2D6SMN1; SMN2HTTMAPT | |
| SCHEMBL29965119 | 0.89 | SMN1; SMN2 (0.55) | CYP1A2SMN1; SMN2MEN1KMT2ACHRNA3 | |
| SCHEMBL31198242 | 0.84 | CHRNA3 (0.47) | CYP1A2CYP2D6SMN1; SMN2HTTMAPT | |
| Trifluoroacetic Acid SCHEMBL31198249 | 0.82 | SMN1; SMN2 (0.48) | SMN1; SMN2HTTMEN1KMT2ACHRNA3 | |
| SCHEMBL30489099 | 0.80 | GAA (0.47) | CYP1A2SMN1; SMN2HTTMAPTMEN1 | |
| SCHEMBL30593635 | 0.78 | SMN1; SMN2 (0.53) | CYP1A2SMN1; SMN2MEN1KMT2ACHRNA3 | |
| SCHEMBL30628898 | 0.78 | SMN1; SMN2 (0.50) | CYP1A2SMN1; SMN2HTTMAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3801553-A2 | PRODRUGS OF FULVESTRANT | Kashiv Biosciences, LLC (US) | 2021-04-14 | — | — | EP | disclosed |