Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B1 | P14061 | 3/20 | 0.42 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.42 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.41 |
| ▸ | SIRT2 | Q8IXJ6 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.37 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29950077 | 0.94 | GSTP1 (0.46) | HSD17B1HSD17B2GSTP1CYP1A2ESR1 | |
| SCHEMBL2789682 | 0.94 | GSTP1 (0.46) | HSD17B1HSD17B2GSTP1CYP1A2ESR1 | |
| SCHEMBL31488899 | 0.91 | ESR1 (0.43) | HSD17B1HSD17B2GSTP1SIRT2CYP1A2 | |
| SCHEMBL16632947 | 0.89 | CYP1A2 (0.41) | HSD17B1HSD17B2CYP1A2ESR1ESR2 | |
| SCHEMBL22255975 | 0.88 | HSD17B1 (0.42) | HSD17B1HSD17B2GSTP1SIRT2CYP1A2 | |
| SCHEMBL12192934 | 0.88 | HSD17B1 (0.47) | HSD17B1HSD17B2GSTP1SIRT2CYP1A2 | |
| SCHEMBL27723548 | 0.85 | CYP1A2 (0.39) | HSD17B1HSD17B2CYP1A2ESR1ESR2 | |
| SCHEMBL5566042 | 0.85 | GSTP1 (0.43) | HSD17B1HSD17B2GSTP1SIRT2CYP1A2 | |
| SCHEMBL3689351 | 0.85 | GSTP1 (0.43) | HSD17B1HSD17B2GSTP1CYP1A2ESR1 | |
| SCHEMBL2789566 | 0.84 | GSTP1 (0.52) | HSD17B1HSD17B2GSTP1CYP1A2ESR1 |
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-20200235320-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE USING THE SAME | LUMINESCENCE TECHNOLOGY CORPORATION (TW) | 2020-07-23 | — | — | US | disclosed |