Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 10/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.36 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16624700 | 0.90 | ROCK2 (0.41) | ROCK2MAOBMAOAAKR1B1MAPT | |
| SCHEMBL16624617 | 0.86 | MAOB (0.44) | ROCK2MAOBMAOAMAPTSMN1; SMN2 | |
| SCHEMBL16624706 | 0.86 | ROCK2 (0.48) | ROCK2MAPTSMN1; SMN2POLBROCK1 | |
| SCHEMBL16624701 | 0.85 | ROCK2 (0.38) | ROCK2MAOBMAOAROCK1 | |
| SCHEMBL16624802 | 0.84 | ROCK2 (0.41) | ROCK2AKR1B1MAPTSMN1; SMN2POLB | |
| SCHEMBL16624715 | 0.83 | ROCK2 (0.46) | ROCK2MAOBMAOASMN1; SMN2KDM4E | |
| SCHEMBL16624702 | 0.82 | ROCK2 (0.46) | ROCK2SMN1; SMN2RAB9AROCK1 | |
| SCHEMBL18165313 | 0.81 | SMPD1 (0.43) | ROCK2MAOBMAOASMN1; SMN2RAB9A | |
| SCHEMBL16624619 | 0.81 | MAOA (0.41) | ROCK2MAOBMAOASMN1; SMN2RAB9A | |
| SCHEMBL16624806 | 0.80 | ROCK2 (0.38) | ROCK2AKR1B1MAPTSMN1; SMN2POLB |
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-3052107-B1 | ORGANIC COMPOUNDS TO TREAT HEPATITIS B VIRUS | NOVARTIS AG (CH) | 2018-05-02 | — | — | EP | disclosed |