Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22730191 | 0.83 | CYP2C19 (0.35) | MAPK1CYP2C19HIF1AALDH1A1TAAR1 | |
| SCHEMBL22730161 | 0.82 | CYP2C19 (0.34) | MAPK1CYP2C19HIF1AALDH1A1TAAR1 | |
| SCHEMBL22730206 | 0.80 | MAPK1 (0.35) | MAPK1CYP2C19HIF1AALDH1A1TAAR1 | |
| SCHEMBL22730229 | 0.79 | TRPA1 (0.47) | MAPK1CYP2C19HIF1ATAAR1CYP2D6 | |
| SCHEMBL22730160 | 0.76 | MAPK1 (0.35) | MAPK1CYP2C19HIF1AALDH1A1TAAR1 | |
| SCHEMBL22319094 | 0.70 | MAPK1 (0.41) | MAPK1CYP2C19HIF1AALDH1A1TAAR1 | |
| SCHEMBL22730183 | 0.68 | CYP2C19 (0.35) | MAPK1CYP2C19HIF1AALDH1A1TAAR1 | |
| SCHEMBL22319081 | 0.68 | CYP2C19 (0.38) | MAPK1CYP2C19HIF1AALDH1A1TAAR1 | |
| SCHEMBL22734818 | 0.67 | CYP2C19 (0.41) | MAPK1CYP2C19HIF1AALDH1A1TAAR1 | |
| SCHEMBL22730218 | 0.66 | MAPK1 (0.46) | MAPK1CYP2C19HIF1AALDH1A1TAAR1 |
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-3747889-A1 | ORGANOSILANE COMPOUNDS HAVING BULKY SUBSTITUENT AND PREPARATION THEREOF | Shin-Etsu Chemical Co., Ltd. (JP) | 2020-12-09 | — | — | EP | disclosed |