Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR2 | P21452 | 6/20 | 0.41 |
| ▸ | TACR3 | P29371 | 6/20 | 0.41 |
| ▸ | TACR1 | P25103 | 5/20 | 0.41 |
| ▸ | GRM1 | Q13255 | 6/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | GSR | P00390 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 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 | |
|---|---|---|---|---|
| SCHEMBL4099250 | 0.81 | MCHR1 (0.40) | GRM1POLBSMN1; SMN2 | |
| SCHEMBL27670851 | 0.81 | POLB (0.33) | GRM1POLBPDE4APDE4BPDE4C | |
| SCHEMBL5436198 | 0.80 | ALDH1A2 (0.40) | ALDH1A1KMT2A | |
| SCHEMBL4093619 | 0.77 | MCHR1 (0.41) | GRM1POLBSMN1; SMN2 | |
| SCHEMBL1997653 | 0.76 | CDK1 (0.41) | GRM1POLBSMN1; SMN2PDE4APDE4B | |
| SCHEMBL5435498 | 0.75 | ALDH1A2 (0.40) | ALDH1A1KMT2A | |
| SCHEMBL4517838 | 0.74 | CDK1 (0.38) | GRM1POLBSMN1; SMN2PDE4APDE4B | |
| SCHEMBL27670910 | 0.74 | FFAR2 (0.32) | GRM1POLB | |
| SCHEMBL4525318 | 0.73 | CNR1 (0.38) | GRM1POLB | |
| SCHEMBL4098422 | 0.72 | MCHR1 (0.41) | GRM1ALDH1A1KMT2APDE4APDE4B |
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 |