Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR2 | Q9NS75 | 3/20 | 0.47 |
| ▸ | CYSLTR1 | Q9Y271 | 3/20 | 0.47 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11128160 | 0.92 | CYSLTR2 (0.54) | CYSLTR2CYSLTR1TAS1R3TAS1R1CYP3A4 | |
| SCHEMBL9276125 | 0.82 | GABRA1 (0.41) | CYSLTR2CYSLTR1GABRA1GABRB2MAPT | |
| SCHEMBL18242291 | 0.81 | GABRA1 (0.41) | CYSLTR2CYSLTR1TAS1R3TAS1R1GABRA1 | |
| SCHEMBL9722014 | 0.81 | TSHR (0.41) | CYSLTR2CYSLTR1TAS1R3TAS1R1GABRA1 | |
| SCHEMBL6055228 | 0.79 | TAS1R3 (0.42) | CYSLTR2CYSLTR1TAS1R3TAS1R1GABRA1 | |
| SCHEMBL14527948 | 0.79 | TAS1R3 (0.39) | CYSLTR2CYSLTR1TAS1R3TAS1R1GABRA1 | |
| SCHEMBL16534648 | 0.79 | TAS1R3 (0.42) | CYSLTR2CYSLTR1TAS1R3TAS1R1GABRA1 | |
| SCHEMBL11075360 | 0.78 | GABBR2 (0.38) | CYSLTR2CYSLTR1GABRA1GABRB2MAPT | |
| SCHEMBL21175585 | 0.78 | TAS1R3 (0.38) | CYSLTR2CYSLTR1TAS1R3TAS1R1GABRA1 | |
| SCHEMBL1828572 | 0.76 | TAS1R3 (0.37) | CYSLTR2CYSLTR1TAS1R3TAS1R1GABRA1 |
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-2017103888-A1 | INDANE DERIVATIVES AND THE USE THEREOF AS SOLUBLE GUANYLATE CYCLASE ACTIVATORS | NOVARTIS AG (CH) | 2017-06-22 | — | — | WO | disclosed |