Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 11/20 | 0.52 |
| ▸ | RORC | P51449 | 1/20 | 0.44 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | COMT | P21964 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | MPL | P40238 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15943367 | 0.80 | AHR (0.48) | — | |
| SCHEMBL28184793 | 0.79 | CYP11B2 (0.49) | SCN9AMPL | |
| SCHEMBL14754382 | 0.79 | KMO (0.47) | RORCSCN9A | |
| SCHEMBL28185438 | 0.76 | SCN9A (0.44) | RORCSCN9ACTSSCTSKMPL | |
| SCHEMBL4524262 | 0.76 | KMO (0.47) | SCN9A | |
| SCHEMBL2698021 | 0.75 | NOTUM (0.61) | NOTUMCYP1A2CASP3COMTPDE3B | |
| SCHEMBL29699355 | 0.75 | SCN9A (0.59) | SCN9A | |
| SCHEMBL11625443 | 0.74 | NOTUM (0.55) | NOTUMCYP1A2CTSSCTSKCASP3 | |
| SCHEMBL474200 | 0.74 | MPL (0.71) | NOTUMCASP3MPL | |
| SCHEMBL17626005 | 0.74 | NOTUM (0.51) | NOTUMCYP1A2CTSSCTSKCASP3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105008353-B | 2-acylaminothiazole derivative or salt thereof | 安斯泰来制药株式会社 | 2017-11-10 | — | — | CN | disclosed |
| CN-106573928-A | 2-aminothiazole derivative or salt thereof | 安斯泰来制药株式会社 | 2017-04-19 | — | — | CN | disclosed |