Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 3/20 | 0.38 |
| ▸ | CNR1 | P21554 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2557200 | 0.81 | ALDH1A1 (0.61) | ALDH1A1TSHRGLA | |
| Water SCHEMBL16335551 | 0.79 | ALDH1A1 (0.59) | ALDH1A1TSHRGLA | |
| SCHEMBL10282142 | 0.79 | ALDH1A1 (0.48) | ALDH1A1TSHRGLACNR2CNR1 | |
| SCHEMBL29239542 | 0.76 | ALDH1A1 (0.46) | ALDH1A1TSHRGLACNR2CNR1 | |
| SCHEMBL21227839 | 0.76 | ALDH1A1 (0.34) | ALDH1A1TSHRGLACNR2CNR1 | |
| SCHEMBL5702191 | 0.75 | ALDH1A1 (0.53) | ALDH1A1TSHRGLACNR2CNR1 | |
| SCHEMBL22939555 | 0.74 | S100B (0.35) | ALDH1A1TSHRGLA | |
| SCHEMBL26274433 | 0.73 | ALDH1A1 (0.47) | ALDH1A1TSHRGLACNR2CNR1 | |
| Ether SCHEMBL17767323 | 0.73 | ALDH1A1 (0.52) | ALDH1A1TSHRGLA | |
| SCHEMBL18545655 | 0.72 | CNR2 (0.35) | ALDH1A1TSHRGLACNR2CNR1 |
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-2766352-B1 | INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME | UNIV HEALTH NETWORK UHN (CA) | 2018-06-06 | — | — | EP | disclosed |