Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MGAM | O43451 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | SI | P14410 | 1/20 | 0.31 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.30 |
| ▸ | TET2 | Q6N021 | 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 | |
|---|---|---|---|---|
| SCHEMBL31252077 | 0.78 | PKM (0.46) | TSHRALDH1A1HSD17B10MGAMGAA | |
| SCHEMBL4763650 | 0.78 | — | — | |
| SCHEMBL27841552 | 0.75 | DGAT1 (0.38) | DGAT1KCNN4 | |
| SCHEMBL15806772 | 0.72 | DGAT1 (0.39) | DGAT1TSHRKCNN4ALDH1A1 | |
| SCHEMBL12361968 | 0.72 | DGAT1 (0.39) | DGAT1TSHRKCNN4ALDH1A1CNR2 | |
| SCHEMBL26292325 | 0.72 | DGAT1 (0.39) | DGAT1TSHRKCNN4ALDH1A1TET2 | |
| SCHEMBL412680 | 0.70 | — | — | |
| SCHEMBL8173647 | 0.70 | — | — | |
| SCHEMBL6280144 | 0.70 | DGAT1 (0.42) | DGAT1KCNN4ALDH1A1CNR2 | |
| SCHEMBL10042967 | 0.70 | DGAT1 (0.34) | DGAT1CNR2 |
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-2021250531-A1 | 4-(4,5-DIHYDRO-1H-PYRAZOL-1-YL)PYRIMIDINE COMPOUND AS CANNABINOID RECEPTOR (CB1 RECEPTOR) ANTAGONISTS AND PHARMACEUTICAL COMPOSITION INCLUDING SAME | 주식회사 종근당 | 2021-12-16 | — | — | WO | disclosed |