Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.50 |
| ▸ | CA2 | P00918 | 4/20 | 0.50 |
| ▸ | CA4 | P22748 | 4/20 | 0.50 |
| ▸ | CA6 | P23280 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | DRD4 | P21917 | 2/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL24727122 | 0.94 | CA1 (0.44) | CA1CA2CA4CA6ALDH1A1 | |
| SCHEMBL24727161 | 0.91 | CA1 (0.42) | CA1CA2CA4CA6ALDH1A1 | |
| SCHEMBL19561472 | 0.83 | CA1 (0.47) | CA1CA2CA4CA6ALDH1A1 | |
| SCHEMBL23395093 | 0.83 | CA1 (0.39) | CA1CA2CA4CA6ALDH1A1 | |
| SCHEMBL21985067 | 0.80 | — | — | |
| SCHEMBL18733082 | 0.76 | CA1 (0.67) | CA1CA2CA4CA6ALDH1A1 | |
| SCHEMBL21985212 | 0.72 | — | — | |
| SCHEMBL6439410 | 0.72 | CA1 (0.75) | CA1CA2CA4CA6ALDH1A1 | |
| SCHEMBL23187868 | 0.71 | CA1 (0.41) | CA1CA2CA4CA6ALDH1A1 | |
| SCHEMBL21183185 | 0.69 | CA1 (0.39) | CA1CA2CA4CA6ALDH1A1 |
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-4074706-A1 | DEUTERATED HETEROCYCLIC COMPOUND, ORGANIC LIGHT EMITTING DEVICE INCLUDING THE SAME AND COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT EMITTING DEVICE | LG Display Co., Ltd. (KR) | 2022-10-19 | — | — | EP | disclosed |