Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL432268 | 0.62 | RAB9A (0.32) | — | |
| SCHEMBL11095241 | 0.60 | LMNA (0.42) | LMNACYP2A6KMT2ASLC6A2SLC6A3 | |
| SCHEMBL20458673 | 0.59 | LMNA (0.57) | LMNACYP2A6 | |
| SCHEMBL28564038 | 0.57 | SLC6A3 (0.42) | LMNACYP2A6KMT2ASLC6A2SLC6A3 | |
| SCHEMBL3256205 | 0.57 | HTR3A (0.41) | LMNACYP2A6GAAKMT2A | |
| SCHEMBL3256203 | 0.57 | HTR3A (0.41) | LMNACYP2A6GAAKMT2A | |
| 1,4-Dichlorobenzene SCHEMBL11243685 | 0.57 | — | — | |
| 1,4-Dichlorobenzene SCHEMBL5191 | 0.57 | — | — | |
| SCHEMBL19562787 | 0.55 | LMNA (0.42) | LMNACYP2A6KMT2ASLC6A2SLC6A3 | |
| 1,4-Dichlorobenzene SCHEMBL29137104 | 0.54 | LMNA (0.73) | LMNACYP2A6 |
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 | disclosed |
| 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 | disclosed |