Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17697793 | 0.80 | CYP1A2 (0.42) | CYP1A2ALDH1A1HSD17B10HPGDCYP2A6 | |
| SCHEMBL28294547 | 0.78 | CYP1A2 (0.36) | CYP1A2ALDH1A1HSD17B10HPGDUGT2B7 | |
| SCHEMBL6677013 | 0.76 | HTR2A (0.57) | CYP1A2ALDH1A1HSD17B10HPGDCYP2A6 | |
| SCHEMBL5517520 | 0.70 | ALDH1A1 (0.37) | CYP1A2ALDH1A1HSD17B10HPGDTSHR | |
| SCHEMBL787068 | 0.70 | CYP1A2 (0.46) | CYP1A2ALDH1A1HSD17B10HPGDCYP2A6 | |
| SCHEMBL30845731 | 0.70 | CYP1A2 (0.46) | CYP1A2ALDH1A1HSD17B10HPGDCYP2A6 | |
| SCHEMBL6249203 | 0.69 | TSHR (0.58) | CYP1A2ALDH1A1HSD17B10HPGDCYP2A6 | |
| SCHEMBL29726949 | 0.69 | CYP1A2 (0.64) | CYP1A2ALDH1A1HSD17B10HPGDCYP2A6 | |
| SCHEMBL460085 | 0.69 | CYP1A2 (0.64) | CYP1A2ALDH1A1HSD17B10HPGDCYP2A6 | |
| SCHEMBL11704687 | 0.68 | PPARG (0.40) | CYP1A2ALDH1A1HSD17B10HPGDCYP2A6 |
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-109765758-A | Siliceous bottom | 罗门哈斯电子材料有限责任公司 | 2019-05-17 | — | — | CN | disclosed |