Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 6/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.34 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.34 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.34 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | CTSD | P07339 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | POLQ | O75417 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1709359 | 0.89 | USP30 (0.38) | SLC6A2SLC6A4PKMCYP3A4 | |
| SCHEMBL10033135 | 0.89 | KCNN4 (0.38) | SLC6A2SLC6A4EPHX1KCNN4TAS1R3 | |
| SCHEMBL1709358 | 0.86 | DPEP1 (0.36) | SLC6A2SLC6A4TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL1709405 | 0.85 | TACR1 (0.38) | HSD11B1TACR1 | |
| SCHEMBL1709459 | 0.84 | CXCR3 (0.34) | SLC6A2SLC6A4PKMSLC6A3FFAR4 | |
| SCHEMBL10032832 | 0.83 | TACR1 (0.36) | HSD11B1TACR1 | |
| SCHEMBL10032831 | 0.83 | TACR1 (0.36) | HSD11B1TACR1 | |
| SCHEMBL1709409 | 0.83 | POLB (0.38) | SLC6A2SLC6A4PKMHSD11B1 | |
| SCHEMBL1709408 | 0.82 | DGAT1 (0.38) | CYP3A4CYP2D6 | |
| SCHEMBL1709489 | 0.82 | OPRM1 (0.37) | SLC6A2SLC6A4PKM |
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-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |