Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 4/20 | 0.31 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.31 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13748207 | 0.81 | TRPV4 (0.35) | TRPV4CYP11B1CYP11B2ADRB2ADRB1 | |
| SCHEMBL21756924 | 0.80 | GABRA1 (0.41) | GABRA1GABRB1GABRB2 | |
| SCHEMBL24606679 | 0.79 | ADRB2 (0.40) | TRPV4GABRA1GABRB2CYP11B1CYP11B2 | |
| SCHEMBL26457748 | 0.79 | CYP11B1 (0.35) | TRPV4CYP11B1CYP11B2ADRB2ADRB1 | |
| SCHEMBL807520 | 0.79 | TRPV4 (0.34) | TRPV4CYP11B1CYP11B2ADRB2ADRB1 | |
| SCHEMBL18999982 | 0.79 | TRPV4 (0.41) | TRPV4CYP11B1CYP11B2ADRB2ADRB1 | |
| SCHEMBL26458345 | 0.78 | KHK (0.36) | TRPV4GABRA1GABRB1CYP11B1CYP11B2 | |
| SCHEMBL13748982 | 0.75 | CYP11B1 (0.39) | CYP11B1CYP11B2 | |
| SCHEMBL21765351 | 0.75 | TRPV4 (0.36) | TRPV4CYP11B1CYP11B2 | |
| SCHEMBL11960299 | 0.74 | TRPV4 (0.31) | TRPV4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020039092-A2 | NOVEL AROMATIC MOLECULES | Xeniopro GmbH (DE) | 2020-02-27 | — | — | WO | disclosed |
| WO-2020039088-A2 | NOVEL COMPOUNDS | Xeniopro GmbH (DE) | 2020-02-27 | — | — | WO | disclosed |
| WO-2020039094-A1 | PHENOXY(HETERO)ARYL ETHERS OF ANTIPROLIFERATIVE ACTIVITY | Xeniopro GmbH (DE) | 2020-02-27 | — | — | WO | disclosed |