Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.41 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.39 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 12/20 | 0.37 |
| ▸ | CA2 | P00918 | 12/20 | 0.37 |
| ▸ | CA4 | P22748 | 12/20 | 0.37 |
| ▸ | CA9 | Q16790 | 12/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | USP19 | O94966 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL8231279 | 0.93 | ABHD6 (0.40) | ABHD6DAGLANR1H2NR1H3PARP1 | |
| SCHEMBL8229767 | 0.92 | ABHD6 (0.43) | ABHD6DAGLANR1H2NR1H3PARP1 | |
| SCHEMBL3495527 | 0.91 | CA1 (0.40) | CA1CA2CA4CA9CYP3A4 | |
| SCHEMBL4978691 | 0.89 | ABHD6 (0.42) | ABHD6DAGLANR1H2NR1H3PARP1 | |
| SCHEMBL13341121 | 0.89 | ABHD6 (0.42) | ABHD6DAGLANR1H2NR1H3PARP1 | |
| SCHEMBL8236501 | 0.86 | ABHD6 (0.42) | ABHD6DAGLANR1H2NR1H3PARP1 | |
| SCHEMBL8238575 | 0.86 | ABHD6 (0.42) | ABHD6DAGLANR1H2NR1H3PARP1 | |
| SCHEMBL8237203 | 0.85 | ABHD6 (0.44) | ABHD6DAGLANR1H2NR1H3PARP1 | |
| SCHEMBL8235940 | 0.85 | ABHD6 (0.44) | ABHD6DAGLANR1H2NR1H3PARP1 | |
| SCHEMBL8238147 | 0.85 | ABHD6 (0.43) | ABHD6DAGLANR1H2NR1H3PARP1 |
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-2007094513-A2 | CYCLIC AMINE COMPOUND AND USE THEREOF FOR THE PROPHYLAXIS OR TREATMENT OF HYPERTENSION | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-08-23 | — | — | WO | disclosed |