Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 7/20 | 0.47 |
| ▸ | HSD17B2 | P37059 | 7/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | TYMS | P04818 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17682962 | 1.00 | HSD17B1 (0.47) | HSD17B1HSD17B2ALOX5CYP1A2CYP3A4 | |
| SCHEMBL17682968 | 0.97 | HSD17B1 (0.45) | HSD17B1HSD17B2ALOX5CYP1A2CYP3A4 | |
| SCHEMBL17779814 | 0.90 | HSD17B1 (0.47) | HSD17B1HSD17B2ALOX5CYP1A2CYP3A4 | |
| SCHEMBL17683009 | 0.89 | HSD17B1 (0.46) | HSD17B1HSD17B2ALOX5CYP1A2CYP3A4 | |
| SCHEMBL17682966 | 0.88 | HSD17B1 (0.45) | HSD17B1HSD17B2ALOX5CYP1A2CYP3A4 | |
| SCHEMBL18162781 | 0.82 | HSD17B1 (0.52) | HSD17B1HSD17B2ALOX5CYP1A2CYP3A4 | |
| SCHEMBL17682950 | 0.82 | ESR2 (0.46) | HSD17B1HSD17B2ALOX5CYP1A2CYP3A4 | |
| SCHEMBL17683012 | 0.82 | ESR2 (0.45) | HSD17B1HSD17B2ALOX5CYP1A2CYP3A4 | |
| SCHEMBL22978419 | 0.81 | HDAC4 (0.41) | ALOX5CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL26243223 | 0.81 | HDAC4 (0.38) | HSD17B1HSD17B2CYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-20160149139-A1 | ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES | UNIVERSAL DISPLAY CORPORATION (US) | 2016-05-26 | — | — | US | disclosed |