Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | PDE9A | O76083 | 5/20 | 0.36 |
| ▸ | EIF4E | P06730 | 5/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | RUNX1 | Q01196 | 1/20 | 0.33 |
| ▸ | CBFB | Q13951 | 1/20 | 0.33 |
| ▸ | FABP4 | P15090 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL5768147 | 0.83 | PDE9A (0.42) | KDM4EALDH1A1PKMHPGDPDE9A | |
| SCHEMBL5768107 | 0.82 | PDE9A (0.45) | KDM4EALDH1A1PKMHPGDPDE9A | |
| SCHEMBL5768878 | 0.81 | EIF4E (0.36) | KDM4EALDH1A1PKMHPGDPDE9A | |
| SCHEMBL4776139 | 0.81 | ALDH1A1 (0.41) | KDM4EALDH1A1PKMHPGDLMNA | |
| SCHEMBL4768853 | 0.80 | ALDH1A1 (0.43) | KDM4EALDH1A1PKMHPGDLMNA | |
| SCHEMBL5766852 | 0.80 | ALDH1A1 (0.41) | KDM4EALDH1A1PKMHPGDLMNA | |
| SCHEMBL4619505 | 0.80 | KDM4E (0.39) | KDM4EALDH1A1PKMHPGDEIF4E | |
| SCHEMBL5769419 | 0.79 | ALDH1A1 (0.45) | KDM4EALDH1A1PKMHPGDLMNA | |
| SCHEMBL5769442 | 0.79 | KDM4E (0.38) | KDM4EALDH1A1PKMHPGDLMNA | |
| SCHEMBL5767198 | 0.78 | PDE9A (0.45) | PDE9ALMNAFABP4 |
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-1687306-A1 | BICYCLIC PYRIMIDIN-4-(3H)-ONES AND ANALOGUES AND DERIVATIVES THEREOF WHICH MODULATE THE FUNCTION OF THE VANILLOID-1 RECEPTOR (VR1) | MERCK SHARP & DOHME LTD. (GB) | 2006-08-09 | — | — | EP | claimed |
| WO-2005049613-A1 | BICYCLIC PYRIMIDIN-4-(3H)-ONES AND ANALOGUES AND DERIVATIVES THEREOF WHICH MODULATE THE FUNCTION OF THE VANILLOID-1 RECEPTOR (VR1) | MERCK SHARP & DOHME LIMITED (GB) | 2005-06-02 | — | — | WO | claimed |