Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH3 | Q9ULD8 | 4/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | GPR68 | Q15743 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL17220381 | 0.85 | APP (0.50) | APPGPR68HRH4NPSR1 | |
| SCHEMBL29223873 | 0.81 | CA1 (0.60) | KCNH3APPGPR68CA1CA2 | |
| SCHEMBL17220394 | 0.79 | VNN1 (0.42) | GPR68KDM4EMEN1KMT2AVNN1 | |
| SCHEMBL17220378 | 0.74 | DHFR (0.43) | CA9KDM4EHSD17B10NPSR1 | |
| SCHEMBL17220190 | 0.74 | HDAC3 (0.48) | GPR68HRH4HRH3HTR7HTR6 | |
| SCHEMBL796742 | 0.71 | TP53 (0.47) | CA9KDM4EMEN1KMT2AHSD17B10 | |
| SCHEMBL17173044 | 0.70 | KCNH3 (0.51) | KCNH3APPGPR68CA1CA2 | |
| SCHEMBL17220339 | 0.70 | RAB9A (0.45) | KDM4EMEN1KMT2AATMHSD17B10 | |
| SCHEMBL17220072 | 0.69 | DHFR (0.31) | APP | |
| SCHEMBL17220062 | 0.69 | CGAS (0.45) | APPCA1CA2CA9KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2616465-B1 | TRIAZINE-OXADIAZOLES | NOVARTIS AG (CH) | 2015-11-04 | — | — | EP | disclosed |