Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM8 | Q7Z2W7 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.37 |
| ▸ | JAK3 | P52333 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | F2R | P25116 | 1/20 | 0.36 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL21094405 | 0.90 | PKM (0.40) | TRPM8ALDH1A1LMNANPSR1NPC1 | |
| SCHEMBL21094393 | 0.87 | NPC1 (0.40) | TRPM8NPC1RAB9AATMKDM4E | |
| SCHEMBL21094397 | 0.86 | NPC1 (0.39) | TRPM8NPC1RAB9AJAK2JAK3 | |
| SCHEMBL21094410 | 0.84 | NPC1 (0.40) | TRPM8NPC1RAB9AATMMAPT | |
| SCHEMBL21094386 | 0.84 | RIPK1 (0.38) | TRPM8NPC1RAB9AATMCHRNB4 | |
| SCHEMBL21094394 | 0.83 | NPC1 (0.41) | TRPM8NPC1RAB9AATMMAPT | |
| SCHEMBL21094092 | 0.83 | GABRA5 (0.40) | NPC1RAB9AATM | |
| SCHEMBL2584512 | 0.79 | TRPM8 (0.46) | TRPM8ALDH1A1LMNAHPGDHSD17B10 | |
| SCHEMBL21094086 | 0.79 | NPC1 (0.40) | TRPM8LMNANPC1RAB9AATM | |
| SCHEMBL21094395 | 0.77 | ALDH1A1 (0.38) | ALDH1A1TSHRNPC1RAB9ACYP1A2 |
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 |