Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | RECQL | P46063 | 1/20 | 0.57 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.53 |
| ▸ | DRD2 | P14416 | 3/20 | 0.52 |
| ▸ | HTR2A | P28223 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.51 |
| ▸ | DRD4 | P21917 | 1/20 | 0.49 |
| ▸ | TNKS | O95271 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | PARP6 | Q2NL67 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3334496 | 0.87 | KDM4E (0.69) | KDM4EALDH1A1TDP1RECQLPANK3 | |
| SCHEMBL3334438 | 0.87 | KDM4E (0.69) | KDM4EALDH1A1TDP1RECQLPANK3 | |
| SCHEMBL8235906 | 0.87 | KDM4E (0.69) | KDM4EALDH1A1TDP1RECQLPANK3 | |
| SCHEMBL3336022 | 0.84 | KDM4E (0.65) | KDM4EALDH1A1TDP1RECQLPANK3 | |
| SCHEMBL5484039 | 0.84 | KDM4E (0.65) | KDM4EALDH1A1TDP1RECQLPANK3 | |
| SCHEMBL5901321 | 0.84 | KDM4E (0.68) | KDM4EALDH1A1TDP1RECQLPANK3 | |
| SCHEMBL13862949 | 0.83 | KDM4E (0.65) | KDM4EALDH1A1TDP1RECQLPANK3 | |
| SCHEMBL29678394 | 0.83 | KDM4E (0.65) | KDM4EALDH1A1TDP1RECQLPANK3 | |
| SCHEMBL3329355 | 0.82 | KDM4E (0.76) | KDM4EALDH1A1TDP1RECQLHDAC2 | |
| SCHEMBL3329378 | 0.82 | KDM4E (0.63) | KDM4EALDH1A1TDP1RECQLPANK3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008112440-A1 | PIPERAZINE AND PIPERIDINE MGLUR5 POTENTIATORS | ASTRAZENECA AB (SE) | 2008-09-18 | — | — | WO | disclosed |