Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 7/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.41 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.41 |
| ▸ | CLK1 | P49759 | 1/20 | 0.41 |
| ▸ | CLK2 | P49760 | 1/20 | 0.41 |
| ▸ | CLK3 | P49761 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6619697 | 1.00 | HTT (0.56) | HTTALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8112159 | 1.00 | HTT (0.56) | HTTALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6618275 | 0.81 | CDC7 (0.43) | NPSR1FGFR1DYRK3CLK1CLK2 | |
| SCHEMBL6618578 | 0.81 | CDC7 (0.43) | NPSR1FGFR1DYRK3CLK1CLK2 | |
| SCHEMBL6616216 | 0.80 | CYSLTR1 (0.46) | RAB9ANPC1FGFR1DYRK3CLK1 | |
| SCHEMBL6615880 | 0.80 | CYSLTR1 (0.46) | RAB9ANPC1FGFR1DYRK3CLK1 | |
| SCHEMBL14015135 | 0.78 | FGFR1 (0.46) | HTTALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6616738 | 0.75 | SMN1; SMN2 (0.58) | ALDH1A1CYP1A2RAB9ANPC1L3MBTL1 | |
| SCHEMBL8880504 | 0.73 | HTT (1.00) | HTTALDH1A1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6618464 | 0.72 | ROCK2 (0.49) | FGFR1DYRK3CLK1CLK2CLK3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0779889-B1 | PYRAZOLO 3,4-g]QUINOXALINE COMPOUNDS WHICH INHIBIT PDGF RECEPTOR PROTEIN TYROSINE KINASE | AVENTIS PHARMA INC (US) | 2004-06-23 | — | — | EP | disclosed |
| US-5476851-A | Administering as therapeutic agents for various disease states which are characterized by uncontrolled cellular proliferation | RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) | 1995-12-19 | — | — | US | disclosed |