Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CD44 | P16070 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL10287421 | 0.82 | ALDH1A1 (0.44) | CYP3A4ALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL20808856 | 0.75 | HEXA (0.35) | SMN1; SMN2 | |
| SCHEMBL24254929 | 0.74 | LIMK1 (0.30) | — | |
| SCHEMBL26204755 | 0.72 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL2206282 | 0.71 | CYP3A4 (0.72) | CYP3A4TSHRPIK3CAALDH1A1HPGD | |
| SCHEMBL30839749 | 0.71 | CYP3A4 (0.72) | CYP3A4TSHRPIK3CAALDH1A1HPGD | |
| SCHEMBL22780781 | 0.70 | ALDH1A1 (0.39) | CYP3A4TSHRALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL19060120 | 0.70 | MKNK1 (0.36) | — | |
| SCHEMBL24612935 | 0.69 | CTSD (0.33) | — | |
| SCHEMBL13263242 | 0.69 | WDR5 (0.32) | — |
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-3674308-B1 | ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG ELECTRONICS CO LTD (KR) | 2021-11-03 | — | — | EP | disclosed |