Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | NLRP3 | Q96P20 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6274430 | 0.95 | AKR1C3 (0.43) | AKR1C3NLRP3KMT2ALRRK2POLB | |
| SCHEMBL6267515 | 0.93 | AKR1C3 (0.42) | AKR1C3NLRP3KMT2ALRRK2POLB | |
| SCHEMBL6272444 | 0.91 | ADRB3 (0.43) | AKR1C3KMT2ALRRK2 | |
| SCHEMBL6272839 | 0.91 | KMT2A (0.42) | KMT2ALRRK2 | |
| SCHEMBL6269797 | 0.91 | LRRK2 (0.49) | AKR1C3KMT2ALRRK2 | |
| SCHEMBL6272911 | 0.90 | KMT2A (0.42) | KMT2ALRRK2POLB | |
| SCHEMBL6282221 | 0.89 | KMT2A (0.39) | AKR1C3KMT2ALRRK2 | |
| SCHEMBL6269042 | 0.89 | AKR1C3 (0.39) | AKR1C3NLRP3KMT2ALRRK2POLB | |
| SCHEMBL6273572 | 0.83 | AKR1C3 (0.39) | AKR1C3NLRP3KMT2ALRRK2POLB | |
| SCHEMBL6273369 | 0.82 | LRRK2 (0.39) | AKR1C3KMT2ALRRK2 |
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 |