Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | TRPM8 | Q7Z2W7 | 5/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | ALPL | P05186 | 1/20 | 0.35 |
| ▸ | ALPI | P09923 | 1/20 | 0.35 |
| ▸ | ALPG | P10696 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21094393 | 0.87 | NPC1 (0.40) | NPC1RAB9ACHRNB4CHRNA3TRPM8 | |
| SCHEMBL21094397 | 0.86 | NPC1 (0.39) | NPC1RAB9ACHRNB4CHRNA3TRPM8 | |
| SCHEMBL21093670 | 0.84 | TRPM8 (0.43) | NPC1RAB9ACHRNB4CHRNA3TRPM8 | |
| SCHEMBL21094410 | 0.84 | NPC1 (0.40) | NPC1RAB9ACHRNB4CHRNA3TRPM8 | |
| SCHEMBL21094394 | 0.83 | NPC1 (0.41) | NPC1RAB9ACHRNB4CHRNA3TRPM8 | |
| SCHEMBL21094086 | 0.83 | NPC1 (0.40) | NPC1RAB9ACHRNB4CHRNA3TRPM8 | |
| SCHEMBL21094092 | 0.83 | GABRA5 (0.40) | NPC1RAB9AATMGRIN2B | |
| SCHEMBL21094405 | 0.79 | PKM (0.40) | NPC1RAB9ATRPM8ATM | |
| SCHEMBL20835498 | 0.74 | CHRNB4 (0.46) | CHRNB4CHRNA3ATMHTR1AHTR7 | |
| SCHEMBL21094102 | 0.74 | KIF11 (0.38) | CHRNB4CHRNA3TRPM8CA1CA2 |
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-2019112024-A1 | PYRROLIDINE COMPOUND | キッセイ薬品工業株式会社 | 2019-06-13 | — | — | WO | disclosed |