Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | LAP3 | P28838 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.36 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.36 |
| ▸ | GMNN | O75496 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | THPO | P40225 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CETP | P11597 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28670353 | 0.83 | OPRM1 (0.52) | OPRM1TSHRSPHK1TP53LAP3 | |
| SCHEMBL4279235 | 0.78 | TSHR (0.52) | OPRM1TSHRSMN1; SMN2SPHK1LMNA | |
| SCHEMBL4271795 | 0.76 | TSHR (0.50) | OPRM1TSHRSMN1; SMN2SPHK1LMNA | |
| SCHEMBL8018388 | 0.76 | — | — | |
| SCHEMBL4278496 | 0.76 | TSHR (0.50) | OPRM1TSHRSMN1; SMN2SPHK1LMNA | |
| SCHEMBL4269418 | 0.76 | TSHR (0.50) | OPRM1TSHRSMN1; SMN2SPHK1LMNA | |
| SCHEMBL4274210 | 0.75 | TSHR (0.54) | OPRM1TSHRSMN1; SMN2SPHK1LMNA | |
| SCHEMBL4275815 | 0.74 | TSHR (0.43) | OPRM1TSHRSMN1; SMN2SPHK1TP53 | |
| SCHEMBL5144466 | 0.74 | OPRM1 (0.48) | OPRM1SPHK1TP53LAP3CYP2D6 | |
| SCHEMBL3116338 | 0.73 | TSHR (0.58) | OPRM1TSHRSMN1; SMN2LMNACYP3A4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0973774-A1 | 1,5-DIHYDRO-PYRAZOLO 3,4-D]-PYRIMIDINONE DERIVATIVES | BAYER AG (DE) | 2000-01-26 | — | — | EP | disclosed |
| WO-1998040384-A1 | 1,5-DIHYDRO-PYRAZOLO[3,4-D]-PYRIMIDINONE DERIVATIVES | BAYER AKTIENGESELLSCHAFT (DE) | 1998-09-17 | — | — | WO | disclosed |