Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.35 |
| ▸ | KMO | O15229 | 1/20 | 0.35 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 2/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | MPL | P40238 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 4/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.32 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.32 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.32 |
| ▸ | ITGAL | P20701 | 1/20 | 0.32 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18724169 | 0.87 | MAPT (0.39) | HTR2AKMOCRHR1CTSSACHE | |
| SCHEMBL18724210 | 0.86 | MAPK1 (0.42) | HTR2AKMOCRHR1CTSSCTSK | |
| SCHEMBL21301076 | 0.84 | MAPT (0.43) | KMOCRHR1ACHES1PR1KMT2A | |
| SCHEMBL21006251 | 0.80 | PDE3B (0.40) | CTSSCTSKMPLS1PR1SPHK2 | |
| SCHEMBL21300945 | 0.80 | KMO (0.49) | HTR2AKMOCRHR1CTSSCTSK | |
| SCHEMBL18724292 | 0.80 | CTSS (0.39) | CRHR1CTSSCTSKMPLS1PR1 | |
| SCHEMBL21005887 | 0.79 | CRHR1 (0.38) | CRHR1CTSSCTSKMPLS1PR1 | |
| SCHEMBL21301089 | 0.79 | ACHE (0.42) | HTR2AKMOMPLACHES1PR1 | |
| SCHEMBL21301171 | 0.79 | KMO (0.40) | HTR2AKMOCTSSMPLACHE | |
| SCHEMBL21300943 | 0.78 | CTSS (0.44) | HTR2AKMOCRHR1CTSSACHE |
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-2963036-B1 | 2-ACYLAMINOTHIAZOLE DERIVATIVE AND SALT THEREOF | ASTELLAS PHARMA INC (JP) | 2019-08-28 | — | — | EP | disclosed |