Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | AURKA | O14965 | 1/20 | 0.54 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.54 |
| ▸ | ACP1 | P24666 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.50 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.47 |
| ▸ | TACR3 | P29371 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ACACA | Q13085 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | DHODH | Q02127 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6534170 | 0.94 | KDM4E (0.58) | KDM4EALDH1A1SMN1; SMN2AURKAAURKB | |
| SCHEMBL6534420 | 0.90 | KDM4E (0.55) | KDM4EALDH1A1SMN1; SMN2AURKAAURKB | |
| SCHEMBL5792917 | 0.89 | KDM4E (0.53) | KDM4EALDH1A1SMN1; SMN2AURKAAURKB | |
| SCHEMBL374734 | 0.88 | KDM4E (0.72) | KDM4EALDH1A1SMN1; SMN2AURKAAURKB | |
| SCHEMBL6534218 | 0.87 | KDM4E (0.51) | KDM4EALDH1A1SMN1; SMN2AURKAAURKB | |
| SCHEMBL13728214 | 0.86 | ACP1 (0.52) | KDM4EALDH1A1SMN1; SMN2AURKAAURKB | |
| SCHEMBL6534437 | 0.84 | MAPT (0.51) | KDM4EALDH1A1SMN1; SMN2AURKAAURKB | |
| SCHEMBL8174141 | 0.83 | RAC1 (0.49) | KDM4EALDH1A1SMN1; SMN2AURKAAURKB | |
| SCHEMBL4496204 | 0.82 | KDM4E (0.65) | KDM4EALDH1A1SMN1; SMN2AURKAAURKB | |
| SCHEMBL29636809 | 0.82 | KDM4E (0.65) | KDM4EALDH1A1SMN1; SMN2AURKAAURKB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1088818-B1 | Quinolin-4-yl derivatives | HOFFMANN LA ROCHE (CH) | 2004-11-03 | — | — | EP | disclosed |
| US-6440995-B1 | NMDA-RECEPTOR SUBTYPE SELECTIVE BLOCKERS | HOFFMAN-LA ROCHE INC. | 2002-08-27 | — | — | US | disclosed |
| EP-1088818-A1 | Quinolin-4-yl derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 2001-04-04 | — | — | EP | disclosed |