Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 1/20 | 0.48 |
| ▸ | ACACB | O00763 | 5/20 | 0.43 |
| ▸ | RET | P07949 | 3/20 | 0.41 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | STS | P08842 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 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 | |
|---|---|---|---|---|
| SCHEMBL31262710 | 0.95 | CYP11B2 (0.54) | CYP11B2ACACBRETSCD5HDAC2 | |
| SCHEMBL30328168 | 0.80 | CYP11B2 (0.48) | CYP11B2ACACBRETSCD5HDAC2 | |
| SCHEMBL30257700 | 0.79 | RET (0.47) | CYP11B2ACACBRET | |
| SCHEMBL30732194 | 0.77 | RET (0.45) | CYP11B2ACACBRETCYP3A4GPR119 | |
| SCHEMBL26924777 | 0.77 | RET (0.45) | CYP11B2ACACBRETCYP3A4GPR119 | |
| SCHEMBL31161269 | 0.76 | CYP3A4 (0.47) | CYP11B2ACACBSCD5HDAC2HDAC1 | |
| SCHEMBL31262435 | 0.76 | ATR (0.34) | CYP3A4CYP2D6HSD17B10CYP2C9TSHR | |
| SCHEMBL30328268 | 0.76 | CYP11B2 (0.49) | CYP11B2ACACBRETHDAC2HDAC1 | |
| SCHEMBL31342350 | 0.75 | CYP11B2 (0.46) | CYP11B2ACACBHDAC2HDAC1STS | |
| SCHEMBL29282350 | 0.75 | POLB (0.48) | RETGPR119POLBALDH1A1TSHR |
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-2024253416-A1 | PYRIMIDINE/PYRIDINE DERIVATIVES OR SALTS THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME | YUHAN CORPORATION (KR) | 2024-12-12 | — | — | WO | disclosed |