Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 13/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4769786 | 0.89 | LMNA (0.41) | P2RX7MAPK1NPSR1L3MBTL1ALDH1A1 | |
| SCHEMBL4776024 | 0.89 | POLB (0.38) | L3MBTL1ALDH1A1LMNAHTTMEN1 | |
| SCHEMBL4511396 | 0.85 | MAPK1 (0.43) | P2RX7MAPK1NPSR1L3MBTL1ALDH1A1 | |
| SCHEMBL4518790 | 0.80 | MAPK1 (0.39) | MAPK1NPSR1MEN1KMT2ATP53 | |
| SCHEMBL4777997 | 0.78 | TSHR (0.39) | P2RX7ALDH1A1LMNAKMT2AMAOB | |
| SCHEMBL4767309 | 0.76 | BRD9 (0.35) | HTTTP53 | |
| SCHEMBL4777218 | 0.76 | CYP2C19 (0.33) | LMNAMEN1KMT2A | |
| SCHEMBL4521143 | 0.76 | MAPK1 (0.44) | MAPK1NPSR1L3MBTL1ALDH1A1LMNA | |
| SCHEMBL4772408 | 0.75 | TRPV4 (0.33) | MAPK1L3MBTL1ALDH1A1LMNATP53 | |
| SCHEMBL4519094 | 0.75 | MAPK1 (0.47) | P2RX7MAPK1NPSR1L3MBTL1ALDH1A1 |
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-1881988-A1 | 2,3-SUBSTITUTED FUSED BICYCLIC PYRIMIDIN-4(3H)-ONES MODULATING THE FUNCTION OF THE VANILLOID-1 RECEPTOR (VR1) | MERCK SHARP & DOHME LTD. (GB) | 2008-01-30 | — | — | EP | disclosed |
| WO-2006122200-A1 | 2,3-SUBSTITUTED FUSED BICYCLIC PYRIMIDIN-4(3H)-ONES MODULATING THE FUNCTION OF THE VANILLOID-1 RECEPTOR (VR1) | MERCK SHARP & DOHME LIMITED (GB) | 2006-11-16 | — | — | WO | disclosed |