Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 2/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | HTR6 | P50406 | 1/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.36 |
| ▸ | SPR | P35270 | 1/20 | 0.35 |
| ▸ | SRD5A2 | P31213 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HTR5A | P47898 | 3/20 | 0.34 |
| ▸ | PROKR1 | Q8TCW9 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20897973 | 0.87 | SRD5A2 (0.38) | BTKHRH4SPRSRD5A2ALDH1A1 | |
| SCHEMBL20971767 | 0.71 | MAPT (0.42) | ALDH1A1MEN1KMT2A | |
| SCHEMBL20971776 | 0.71 | TRPV1 (0.35) | BTKPROKR1 | |
| SCHEMBL20971733 | 0.71 | MAPT (0.44) | ALDH1A1MEN1KMT2A | |
| SCHEMBL21723312 | 0.70 | IDO1 (0.39) | BTKSRD5A2ALDH1A1 | |
| SCHEMBL20897934 | 0.69 | HTR2C (0.43) | HTR1AHTR2AHRH4 | |
| SCHEMBL15537076 | 0.69 | SRD5A2 (0.51) | HRH4SRD5A2ALDH1A1PROKR1KMT2A | |
| Hydrochloric Acid SCHEMBL20897971 | 0.68 | HTR2C (0.42) | HTR1AHTR2AHRH4 | |
| SCHEMBL3024877 | 0.67 | GRM2 (0.42) | HRH4SPR | |
| SCHEMBL12497411 | 0.65 | SIRT1 (0.40) | HTR1AHTR2AHTR7HTR6HTR5A |
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-2019072978-A1 | MITOCHONDRIAL INHIBITORS FOR THE TREATMENT OF PROLIFERATION DISORDERS | Basilea Pharmaceutica International AG (CH) | 2019-04-18 | — | — | WO | disclosed |