Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | RAD52 | P43351 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 5/20 | 0.41 |
| ▸ | DRD1 | P21728 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | DRD5 | P21918 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5789193 | 0.82 | CA2 (0.41) | CA2CA9DRD2ALDH1A1PDE4B | |
| SCHEMBL5277209 | 0.81 | CA2 (0.41) | CA2CA9ALDH1A1KMT2ANPC1 | |
| SCHEMBL14376713 | 0.80 | CA2 (0.46) | CA2CA9RAD52DRD2DRD1 | |
| SCHEMBL5241961 | 0.78 | ADRA2A (0.45) | ALDH1A1AGTR2KDM4E | |
| SCHEMBL9425191 | 0.77 | L3MBTL1 (0.51) | ALDH1A1KMT2ANPC1KDM4E | |
| SCHEMBL5276265 | 0.76 | MCL1 (0.42) | CA2CA9DRD2ALDH1A1MCL1 | |
| SCHEMBL5241484 | 0.76 | BCHE (0.47) | ALDH1A1KMT2AMCL1 | |
| SCHEMBL5242056 | 0.75 | KMT2A (0.45) | CA2CA9DRD2ALDH1A1KMT2A | |
| SCHEMBL5786442 | 0.74 | HDAC6 (0.46) | — | |
| SCHEMBL5289084 | 0.72 | SMN1; SMN2 (0.61) | ALDH1A1KMT2ANPC1KDM4E |
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-1833797-A1 | AZACYCLIC COMPOUNDS AS INHBITORS OF SENSORY NEURONE SPECIFIC CHANNELS (SNS) | VERNALIS (R&D) LTD (GB) | 2007-09-19 | — | — | EP | disclosed |
| WO-2006082354-A1 | AZACYCLIC COMPOUNDS AS INHIBITORS OF SENSORY NEURONE SPECIFIC CHANNELS ( SNS ) | VERNALIS (R & D) LIMITED (GB) | 2006-08-10 | — | — | WO | disclosed |