Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | NAAA | Q02083 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29438451 | 0.78 | TSHR (0.53) | NAAAHPGDTSHRHTTALDH1A1 | |
| SCHEMBL4565867 | 0.73 | HDAC3 (0.71) | KDM4ENAAAHPGDTSHRHTT | |
| SCHEMBL14812246 | 0.72 | NAAA (0.66) | NAAAHPGDTSHRHTTALDH1A1 | |
| SCHEMBL14812810 | 0.72 | NAAA (0.66) | NAAAHPGDTSHRHTTALDH1A1 | |
| SCHEMBL14816297 | 0.72 | NAAA (0.66) | NAAAHPGDTSHRHTTALDH1A1 | |
| SCHEMBL13516205 | 0.71 | TSHR (0.54) | KDM4EHPGDTSHRHTTALDH1A1 | |
| SCHEMBL11148143 | 0.70 | NAAA (0.59) | KDM4ENAAAALDH1A1SMN1; SMN2L3MBTL1 | |
| SCHEMBL10961330 | 0.70 | HPGD (0.88) | KDM4ENAAAHPGDTSHRHTT | |
| SCHEMBL8207967 | 0.70 | HPGD (0.88) | KDM4ENAAAHPGDTSHRHTT | |
| SCHEMBL5433157 | 0.70 | BRD4 (0.53) | NAAAHPGDTSHRHTTALDH1A1 |
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-2178845-A2 | INHIBITORS OF 11B-HYDROXYSTEROID DEHYDROGENASE | F. Hoffmann-Roche AG (CH) | 2010-04-28 | — | — | EP | disclosed |
| WO-2009010416-A2 | INHIBITORS OF 11B-HYDROXYSTEROID DEHYDROGENASE | F. HOFFMANN-LA ROCHE AG (CH) | 2009-01-22 | — | — | WO | disclosed |