Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | CNR1 | P21554 | 3/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | TPH1 | P17752 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21258696 | 0.90 | GRM5 (0.38) | GRM5OPRD1KCNH2CNR1 | |
| SCHEMBL21258721 | 0.90 | GRM5 (0.34) | GRM5OPRD1KCNH2CNR1TPH1 | |
| SCHEMBL21258674 | 0.81 | PTGIR (0.34) | GRM5CYP3A4 | |
| SCHEMBL21258710 | 0.81 | ALDH1A1 (0.33) | CYP3A4 | |
| SCHEMBL21259000 | 0.79 | CKS1B (0.36) | CYP3A4 | |
| SCHEMBL21258959 | 0.79 | PTGIR (0.38) | CYP3A4 | |
| SCHEMBL21258923 | 0.79 | CYP3A4 (0.36) | CNR1CYP3A4 | |
| SCHEMBL21258656 | 0.79 | PTGIR (0.42) | CNR1 | |
| SCHEMBL21258877 | 0.79 | PTGIR (0.37) | GRM5KCNH2CNR1 | |
| SCHEMBL21258940 | 0.78 | PTGIR (0.35) | CYP3A4 |
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-2019154363-A1 | PROSTACYCLIN RECEPTOR AGONIST | 南京明德新药研发有限公司 | 2019-08-15 | — | — | WO | disclosed |