Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.37 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.37 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | PI4KA | P42356 | 1/20 | 0.31 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.31 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.31 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22955666 | 0.89 | HTT (0.37) | HTTNCOA1NCOA3MEN1ALDH1A1 | |
| SCHEMBL22951469 | 0.74 | MEN1 (0.33) | HTTMEN1ALDH1A1KMT2API4KA | |
| SCHEMBL1243349 | 0.72 | SMPD3 (0.51) | ALDH1A1TLR7TDP1L3MBTL1 | |
| SCHEMBL11450765 | 0.70 | TBXAS1 (0.37) | HTTTBXAS1TLR7TDP1L3MBTL1 | |
| SCHEMBL7250893 | 0.69 | L3MBTL1 (0.39) | MEN1ALDH1A1KMT2ATLR7TDP1 | |
| SCHEMBL22911106 | 0.69 | MEN1 (0.42) | HTTMEN1ALDH1A1KMT2A | |
| SCHEMBL15598315 | 0.68 | ALOX15 (0.33) | MEN1ALDH1A1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL1555530 | 0.67 | TDP1 (0.39) | HTTMEN1ALDH1A1KMT2ATDP1 | |
| SCHEMBL21104110 | 0.67 | HTT (0.35) | HTTNCOA1NCOA3MEN1ALDH1A1 | |
| SCHEMBL25101295 | 0.67 | HTT (0.33) | HTTNCOA1NCOA3MEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4269980-A | TRANQUILIZERS; ANTICONVULSANTS | AMERICAN CYANAMID COMPANY (US) | 1981-05-26 | — | — | US | disclosed |