Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 12/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL11387438 | 0.95 | ALDH1A1 (0.48) | HRH3KCNH2ALDH1A1KDM4EPOLB | |
| SCHEMBL6486975 | 0.80 | ALOX15 (0.40) | ALDH1A1KDM4EALOX15TSHRCYP2C9 | |
| SCHEMBL28290468 | 0.78 | ALOX15 (0.47) | ALDH1A1KDM4EALOX15TSHRCYP2C9 | |
| SCHEMBL15084367 | 0.76 | LMNA (0.52) | ALDH1A1KDM4EALOX15TSHRCYP2C9 | |
| SCHEMBL19381825 | 0.76 | LMNA (0.52) | ALDH1A1KDM4EALOX15TSHRCYP2C9 | |
| SCHEMBL14375259 | 0.74 | ALOX15 (0.52) | HRH3ALDH1A1ALOX15TSHRCYP2C9 | |
| SCHEMBL3985348 | 0.72 | ALOX15 (0.40) | ALDH1A1ALOX15TSHRCYP2C9 | |
| SCHEMBL5956160 | 0.72 | CYP3A4 (0.46) | ALDH1A1KDM4ETSHR | |
| SCHEMBL4487346 | 0.71 | ALOX15 (0.59) | ALDH1A1ALOX15TSHRCYP2C9 | |
| SCHEMBL15765560 | 0.70 | HTT (0.47) | ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-106573928-A | 2-aminothiazole derivative or salt thereof | 安斯泰来制药株式会社 | 2017-04-19 | — | — | CN | disclosed |