Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 8/20 | 0.46 |
| ▸ | HPGD | P15428 | 8/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 7/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 1/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| Naphthalene SCHEMBL28609503 | 0.78 | CYP2A6 (0.47) | ALDH1A1HSD17B10CYP1A2TSHRCYP3A4 | |
| SCHEMBL29906043 | 0.77 | ALDH1A1 (0.71) | ALDH1A1HSD17B10HPGDCYP1A2THRB | |
| SCHEMBL634848 | 0.77 | ALDH1A1 (0.71) | ALDH1A1HSD17B10HPGDCYP1A2THRB | |
| SCHEMBL6538859 | 0.77 | ALDH1A1 (0.71) | ALDH1A1HSD17B10HPGDCYP1A2THRB | |
| SCHEMBL26440 | 0.77 | ALDH1A1 (0.71) | ALDH1A1HSD17B10HPGDCYP1A2THRB | |
| SCHEMBL20994180 | 0.74 | ALDH1A1 (0.67) | ALDH1A1HSD17B10HPGDCYP1A2THRB | |
| SCHEMBL21143411 | 0.74 | ALDH1A1 (0.67) | ALDH1A1HSD17B10HPGDCYP1A2THRB | |
| SCHEMBL8214745 | 0.74 | ALDH1A1 (0.67) | ALDH1A1HSD17B10HPGDCYP1A2THRB | |
| SCHEMBL21885746 | 0.74 | ALDH1A1 (0.67) | ALDH1A1HSD17B10HPGDCYP1A2THRB | |
| SCHEMBL21885748 | 0.74 | ALDH1A1 (0.67) | ALDH1A1HSD17B10HPGDCYP1A2THRB |
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-104028308-A | Nanometer photo-catalyst used in producing hydrogen by decomposing water under visible light response and application of nanometer photo-catalyst | XINJIANG TECH INST PHYSICS CAS | 2014-09-10 | — | — | CN | claimed |