Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.41 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 4/20 | 0.37 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.36 |
| ▸ | CTSS | P25774 | 2/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MPL | P40238 | 1/20 | 0.33 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21300945 | 0.91 | KMO (0.49) | KMOTRPV4ACHES1PR1CTSS | |
| SCHEMBL21301089 | 0.87 | ACHE (0.42) | KMOTRPV4ACHES1PR1LRRK2 | |
| SCHEMBL21300934 | 0.83 | KMO (0.40) | KMOTRPV4ACHES1PR1CTSS | |
| SCHEMBL21301171 | 0.81 | KMO (0.40) | KMOTRPV4ACHES1PR1CTSS | |
| SCHEMBL21300943 | 0.81 | CTSS (0.44) | KMOTRPV4ACHES1PR1CTSS | |
| SCHEMBL18724169 | 0.81 | MAPT (0.39) | KMOACHES1PR1CTSSMAPT | |
| SCHEMBL21301076 | 0.80 | MAPT (0.43) | KMOACHES1PR1KDM4EALDH1A1 | |
| SCHEMBL18724210 | 0.79 | MAPK1 (0.42) | KMOACHES1PR1CTSSCTSK | |
| SCHEMBL17400508 | 0.77 | MPL (0.52) | ACHES1PR1MPL | |
| SCHEMBL21301082 | 0.75 | HTR2A (0.35) | KMOACHES1PR1CTSSCTSK |
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 |