Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | PDE9A | O76083 | 3/20 | 0.34 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | KDM5A | P29375 | 1/20 | 0.31 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 2/20 | 0.31 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.31 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.31 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.31 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4774088 | 0.90 | CNR1 (0.37) | HPGDKDM4EALDH1A1PKMPDE9A | |
| SCHEMBL4290620 | 0.89 | PDE9A (0.45) | HPGDKDM4EALDH1A1PKMPDE9A | |
| SCHEMBL4290740 | 0.88 | MEN1 (0.42) | HPGDKDM4EALDH1A1PKMPDE9A | |
| SCHEMBL4774180 | 0.83 | AVPR2 (0.37) | HPGDKDM4EALDH1A1PKMPDE9A | |
| SCHEMBL4775972 | 0.83 | KDM4E (0.36) | HPGDKDM4EALDH1A1PKMMEN1 | |
| SCHEMBL4776108 | 0.82 | KDM4E (0.38) | HPGDKDM4EALDH1A1PKMMEN1 | |
| SCHEMBL4297801 | 0.76 | PDE9A (0.48) | HPGDKDM4EALDH1A1PKMPDE9A | |
| SCHEMBL4296187 | 0.76 | PDE9A (0.48) | HPGDKDM4EALDH1A1PKMPDE9A | |
| SCHEMBL4292483 | 0.74 | PDE9A (0.36) | HPGDKDM4EALDH1A1PKMPDE9A | |
| SCHEMBL4290696 | 0.73 | ALDH1A1 (0.38) | HPGDKDM4EALDH1A1PKMPDE9A |
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 |