Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.33 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | WEE1 | P30291 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 1/20 | 0.31 |
| ▸ | CCND1 | P24385 | 1/20 | 0.31 |
| ▸ | CCND2 | P30279 | 1/20 | 0.31 |
| ▸ | CCND3 | P30281 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL11052481 | 0.91 | MKNK1 (0.34) | MAOAMAOBMKNK1MKNK2CHRNA7 | |
| SCHEMBL11056309 | 0.89 | MEN1 (0.36) | MAOAMAOBL3MBTL1GBA1MKNK1 | |
| SCHEMBL11059310 | 0.88 | CHRNA7 (0.44) | CHRNA7P2RX7 | |
| SCHEMBL11053108 | 0.86 | MKNK1 (0.43) | MKNK1MKNK2ALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL11055490 | 0.85 | MAOA (0.38) | MAOAMAOBGBA1MKNK1MKNK2 | |
| SCHEMBL11059426 | 0.80 | KMT2A (0.35) | MAOAMAOBMKNK1MKNK2CHRNA7 | |
| SCHEMBL11053517 | 0.80 | TDP1 (0.38) | MAOAMAOBMKNK1MKNK2CHRNA7 | |
| SCHEMBL11059003 | 0.80 | FGFR1 (0.39) | — | |
| SCHEMBL11056733 | 0.80 | ALDH1A1 (0.37) | ALDH1A1WEE1CDK4CCND1CCND2 | |
| SCHEMBL11055055 | 0.80 | CHRNA7 (0.43) | MKNK2CHRNA7P2RX7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4452980-A | DIARRHEA | WILLIAM H. RORER, INC. (US) | 1984-06-05 | — | — | US | disclosed |
| US-4246409-A | ANTIDIARRHEAL AGENTS | WILLIAM H. RORER, INC. (US) | 1981-01-20 | — | — | US | disclosed |
| US-4225315-A | Triazinones from amidinoureas | WILLIAM H. RORER, INC. (US) | 1980-09-30 | — | — | US | disclosed |