Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.57 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | LTA4H | P09960 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | KDM1A | O60341 | 2/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10512212 | 0.85 | CHRNB2 (0.43) | CHRNB2CHRNA4CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL10512608 | 0.84 | NAMPT (0.44) | CHRNB2CHRNA4CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL2255128 | 0.77 | DPP7 (0.52) | ALDH1A1KDM4E | |
| SCHEMBL518257 | 0.76 | DPP7 (0.50) | CYP1A2CYP2D6ALDH1A1KDM4ECYP2C19 | |
| SCHEMBL8522936 | 0.75 | CYP1A2 (0.60) | CYP1A2CYP2D6ALDH1A1KDM4EPKM | |
| SCHEMBL10512848 | 0.74 | MAPT (0.48) | CYP1A2CYP2D6ALDH1A1NAMPTCYP2C19 | |
| SCHEMBL8647480 | 0.74 | DPP7 (0.47) | ALDH1A1KDM4EKDM1AMAOA | |
| SCHEMBL6538443 | 0.73 | DPP7 (0.65) | CHRNB2CHRNA4CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL5361875 | 0.73 | CYP1A2 (0.75) | CYP1A2CYP2D6ALDH1A1KDM4EPKM | |
| SCHEMBL2861457 | 0.73 | CYP1A2 (1.00) | CYP1A2CYP2D6ALDH1A1LTA4HCHRM2 |
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-1951689-A1 | P2X7 RECEPTOR ANTAGONISTS AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2008-08-06 | — | — | EP | disclosed |
| WO-2007056046-A1 | P2X7 RECEPTOR ANTAGONISTS AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2007-05-18 | — | — | WO | disclosed |