Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | PAM | P19021 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | TNKS | O95271 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3300954 | 0.83 | ALOX15 (0.48) | ALDH1A1L3MBTL1SMN1; SMN2MAPTCYP1A2 | |
| SCHEMBL7384196 | 0.77 | POLB (0.43) | KDM4EALDH1A1L3MBTL1SMN1; SMN2MAPT | |
| SCHEMBL535167 | 0.74 | GABBR2 (0.40) | SMN1; SMN2PKMPAMKMT2A | |
| SCHEMBL4992922 | 0.73 | KDM4E (0.42) | KDM4EHTTALDH1A1GAAL3MBTL1 | |
| SCHEMBL7017014 | 0.73 | HCAR2 (0.35) | ALDH1A1PKMHCAR2 | |
| SCHEMBL5727816 | 0.73 | PTPN1 (0.38) | KDM4EALDH1A1HPGDMAPTNPSR1 | |
| SCHEMBL27834761 | 0.72 | MAPT (0.43) | KDM4EHTTALDH1A1L3MBTL1SMN1; SMN2 | |
| SCHEMBL2363130 | 0.72 | GPR174 (0.38) | ALDH1A1GAAL3MBTL1SMN1; SMN2MAPT | |
| SCHEMBL21026012 | 0.72 | ATM (0.56) | KDM4EHTTALDH1A1GAASMN1; SMN2 | |
| SCHEMBL790911 | 0.72 | ALDH1A1 (0.36) | ALDH1A1L3MBTL1SMN1; SMN2MAPTCYP1A2 |
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-1794162-A1 | PURINE DERIVATIVES AS A3 AND A1 ADENOSINE RECEPTOR AGONISTS | The Government of the United States of America, as repres. by the Secretary of Health and Human Services, Nat. Inst. of Health (US) | 2007-06-13 | — | — | EP | disclosed |
| WO-2006031505-A1 | PURINE DERIVATIVES AS A3 AND A1 ADENOSINE RECEPTOR AGONISTS | GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2006-03-23 | — | — | WO | disclosed |