Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.39 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.39 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 4/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4627162 | 0.74 | TXNRD1 (0.43) | TXNRD1TXNRD3TXNRD2CDK2MAPT | |
| SCHEMBL1856618 | 0.68 | ALDH1A1 (0.49) | CA9MAPTKMT2AALOX15SMN1; SMN2 | |
| SCHEMBL3327817 | 0.67 | MAPT (0.56) | TXNRD1TXNRD3TXNRD2MAPTKMT2A | |
| SCHEMBL29538041 | 0.66 | SNCA (0.50) | CA12CA9MAPTKMT2AALOX15 | |
| SCHEMBL4776517 | 0.66 | SNCA (0.50) | CA12CA9MAPTKMT2AALOX15 | |
| SCHEMBL29901773 | 0.66 | TXNRD1 (0.64) | TXNRD1TXNRD3TXNRD2CDK2MAPT | |
| SCHEMBL30077215 | 0.65 | XDH (0.41) | CDK2KMT2ASMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL26688243 | 0.64 | TXNRD1 (0.46) | TXNRD1TXNRD3TXNRD2CDK2CA12 | |
| SCHEMBL29901717 | 0.64 | TXNRD1 (0.56) | TXNRD1TXNRD3TXNRD2CDK2MAPT | |
| SCHEMBL1559789 | 0.64 | GPR35 (0.43) | MAPTKMT2AALOX15SMN1; SMN2KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2324005-A1 | NOVEL METHYLENEDIOXY PHENOLIC COMPOUNDS AND THEIR USE TO TREAT DISEASE | The Ohio State University Research Foundation (US) | 2011-05-25 | — | — | EP | disclosed |
| WO-2010017323-A1 | NOVEL METHYLENEDIOXY PHENOLIC COMPOUNDS AND THEIR USE TO TREAT DISEASE | THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2010-02-11 | — | — | WO | disclosed |