Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | LDHA | P00338 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2231375 | 0.75 | NOS2 (0.41) | HCAR2LDHATSHRLMNAHTT | |
| SCHEMBL26977763 | 0.72 | CASP1 (0.33) | HCAR2 | |
| SCHEMBL22307576 | 0.72 | TSHR (0.43) | TSHRLMNAHTT | |
| SCHEMBL31493066 | 0.69 | HCAR2 (0.37) | HCAR2LDHALMNAHTT | |
| SCHEMBL2231369 | 0.69 | NOS3 (0.37) | — | |
| SCHEMBL28135777 | 0.67 | HCAR2 (0.36) | HCAR2TSHR | |
| SCHEMBL22991653 | 0.67 | HCAR2 (0.30) | HCAR2 | |
| SCHEMBL4833930 | 0.65 | TLR7 (0.36) | LMNA | |
| SCHEMBL31358629 | 0.65 | HCAR2 (0.40) | HCAR2TSHRLMNAHTT | |
| SCHEMBL12590777 | 0.65 | CYP1A2 (0.46) | TSHR |
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-2018011164-A1 | FUSED PYRIMIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2018-01-18 | — | — | WO | disclosed |