Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.42 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 16/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
| ▸ | CETP | P11597 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6862336 | 0.90 | TACR1 (0.51) | GPBAR1SYKTACR1 | |
| SCHEMBL6868763 | 0.90 | TACR1 (0.41) | SYKTACR1CCR2CETP | |
| SCHEMBL6870600 | 0.86 | CETP (0.50) | GPBAR1SYKTACR1CETP | |
| SCHEMBL6872715 | 0.85 | GPBAR1 (0.43) | GPBAR1TACR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6873362 | 0.85 | TACR1 (0.51) | GPBAR1SYKTACR1 | |
| SCHEMBL6868260 | 0.85 | GPBAR1 (0.42) | GPBAR1TACR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7045412 | 0.84 | SYK (0.43) | SYKTACR1CCR2CETP | |
| SCHEMBL6872543 | 0.83 | GPBAR1 (0.45) | GPBAR1TACR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6862187 | 0.79 | TACR1 (0.62) | GPBAR1TACR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6016480 | 0.76 | TACR1 (0.49) | GPBAR1SYKTACR1 |
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-1187814-B1 | 5-PHENYL-PYRIMIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2004-08-18 | — | — | EP | claimed |