Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.37 |
| ▸ | MALT1 | Q9UDY8 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL846696 | 0.85 | BCHE (0.43) | ALDH1A1TP53GAAKMT2AMAPT | |
| SCHEMBL846996 | 0.83 | KDM4E (0.42) | KDM4CKDM4EALDH1A1TP53FAAH | |
| SCHEMBL844641 | 0.83 | HDAC1 (0.41) | KDM4CKDM4EALDH1A1MALT1KMT2A | |
| SCHEMBL844640 | 0.83 | HDAC1 (0.41) | KDM4CKDM4EALDH1A1MALT1KMT2A | |
| SCHEMBL848239 | 0.82 | RAB9A (0.47) | KDM4CKDM4EALDH1A1TP53FAAH | |
| SCHEMBL2708377 | 0.69 | NPC1 (0.53) | KDM4EALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL846901 | 0.68 | TRPV1 (0.61) | KDM4EALDH1A1TP53MAPTNPC1 | |
| SCHEMBL846141 | 0.67 | MAPT (0.42) | ALDH1A1TP53GAAKMT2AMAPT | |
| SCHEMBL846808 | 0.67 | KDM4E (0.45) | KDM4EALDH1A1TP53GAAKMT2A | |
| SCHEMBL846572 | 0.66 | HDAC1 (0.44) | ALDH1A1KMT2ANPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1603883-B1 | QUINOLINE-DERIVED AMIDE MODULATORS OF VANILLOID VR1 RECEPTOR | JANSSEN PHARMACEUTICA NV (BE) | 2012-03-28 | — | — | EP | claimed |