Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LDHB | P07195 | 8/20 | 0.40 |
| ▸ | LDHA | P00338 | 7/20 | 0.40 |
| ▸ | PDE2A | O00408 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5364018 | 0.74 | LDHB (0.50) | LDHBLDHAPDE2ANOS3NOS1 | |
| SCHEMBL30410294 | 0.67 | LDHB (0.61) | LDHBLDHAPPARG | |
| SCHEMBL18075387 | 0.64 | LDHB (0.49) | LDHBLDHAPDE2ANOS3NOS1 | |
| SCHEMBL30992205 | 0.63 | LDHB (0.48) | LDHBLDHANOS3NOS1NOS2 | |
| SCHEMBL6809648 | 0.63 | ALDH1A1 (0.51) | LDHBLDHAPDE2ANOS3NOS1 | |
| SCHEMBL27560649 | 0.62 | SMN1; SMN2 (0.59) | EPHX2 | |
| SCHEMBL28404272 | 0.62 | TRPV1 (0.52) | LDHBLDHAMAPTOPRM1OPRD1 | |
| SCHEMBL21985347 | 0.62 | PDE2A (0.54) | PDE2A | |
| SCHEMBL6676161 | 0.61 | CES2 (0.59) | LDHBLDHAPDE2ANOS3NOS1 | |
| SCHEMBL1566692 | 0.61 | CES2 (0.59) | LDHBLDHAPDE2ANOS3NOS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3087060-B1 | PYRIMIDONE CARBOXAMIDE COMPOUNDS AS PDE2 INHIBITORS | MERCK SHARP & DOHME (US) | 2020-05-13 | — | — | EP | disclosed |