Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 3/20 | 0.46 |
| ▸ | CTSK | P43235 | 3/20 | 0.46 |
| ▸ | PTPRB | P23467 | 6/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20281032 | 1.00 | CTSS (0.46) | CTSSCTSKPTPRBCHRNB2CHRNB4 | |
| SCHEMBL1096245 | 0.86 | CTSS (0.48) | CTSSCTSKPTPRBCHRNB2CHRNB4 | |
| SCHEMBL4600416 | 0.86 | CTSS (0.48) | CTSSCTSKPTPRBCHRNB2CHRNB4 | |
| SCHEMBL4789660 | 0.86 | CTSS (0.48) | CTSSCTSKPTPRBCHRNB2CHRNB4 | |
| SCHEMBL14923678 | 0.85 | CTSS (0.47) | CTSSCTSKPTPRBCHRNB2CHRNB4 | |
| SCHEMBL4596762 | 0.85 | CTSS (0.47) | CTSSCTSKPTPRBCHRNB2CHRNB4 | |
| SCHEMBL1095180 | 0.84 | CTSK (0.46) | CTSSCTSKPTPRBCHRNB2CHRNB4 | |
| SCHEMBL1105001 | 0.84 | CTSK (0.49) | CTSSCTSKPTPRBMAPTATM | |
| SCHEMBL13536928 | 0.83 | CTSK (0.46) | CTSSCTSKPTPRBMAPTATM | |
| SCHEMBL1105017 | 0.83 | CTSK (0.48) | CTSSCTSKPTPRBCHRNB2CHRNB4 |
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-2589592-A1 | NOVEL NICOTINAMIDE DERIVATIVES OR SALTS THEREOF | FUJIFILM Corporation (JP) | 2013-05-08 | — | — | EP | disclosed |