Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 5/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6269042 | 0.93 | AKR1C3 (0.39) | AKR1C3POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6272705 | 0.91 | LRRK2 (0.39) | AKR1C3POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6272989 | 0.90 | GAA (0.38) | POLBNPC1RAB9ASMN1; SMN2KMT2A | |
| SCHEMBL6267515 | 0.89 | AKR1C3 (0.42) | AKR1C3POLBKMT2ALRRK2NLRP3 | |
| SCHEMBL6272458 | 0.89 | NLRP3 (0.40) | AKR1C3SMN1; SMN2KMT2AGAALRRK2 | |
| SCHEMBL6274430 | 0.84 | AKR1C3 (0.43) | AKR1C3POLBKMT2ALRRK2NLRP3 | |
| SCHEMBL6273576 | 0.83 | AKR1C3 (0.37) | AKR1C3POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6273580 | 0.83 | AKR1C3 (0.37) | AKR1C3POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL6273366 | 0.83 | AKR1C3 (0.42) | AKR1C3POLBKMT2ALRRK2NLRP3 | |
| SCHEMBL6270665 | 0.82 | LRRK2 (0.39) | AKR1C3POLBSMN1; SMN2KMT2AGAA |
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-2005110981-A1 | AMINOALCOHOL DERIVATIVES | ASTELLAS PHARMA INC. (JP) | 2005-11-24 | — | — | WO | disclosed |