Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 2/20 | 0.40 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.37 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 4/20 | 0.35 |
| ▸ | MLNR | O43193 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30084636 | 1.00 | ALDH1A1 (0.41) | ALDH1A1HSD17B10THRBTDP1PGR | |
| SCHEMBL706442 | 1.00 | ALDH1A1 (0.41) | ALDH1A1HSD17B10THRBTDP1PGR | |
| SCHEMBL3271140 | 0.94 | PGR (0.37) | ALDH1A1HSD17B10THRBTDP1PGR | |
| SCHEMBL23697606 | 0.88 | L3MBTL1 (0.43) | ALDH1A1HSD17B10THRBTDP1PGR | |
| SCHEMBL24279383 | 0.87 | CYP2A6 (0.39) | ALDH1A1HSD17B10THRBTDP1PGR | |
| SCHEMBL21142136 | 0.87 | ALDH1A1 (0.44) | ALDH1A1HSD17B10THRBTDP1PGR | |
| SCHEMBL17151618 | 0.87 | L3MBTL1 (0.42) | ALDH1A1HSD17B10TDP1PGRHPGD | |
| SCHEMBL17151707 | 0.87 | L3MBTL1 (0.42) | ALDH1A1HSD17B10TDP1PGRHPGD | |
| SCHEMBL18998379 | 0.87 | PDK2 (0.35) | ALDH1A1HSD17B10THRBTDP1PGR | |
| SCHEMBL18878277 | 0.87 | L3MBTL1 (0.42) | ALDH1A1HSD17B10TDP1PGRHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-114957205-A | Organic electroluminescent compounds, various host materials and organic electroluminescent device comprising the same | 罗门哈斯电子材料韩国有限公司 | 2022-08-30 | — | — | CN | disclosed |