Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRBN | Q96SW2 | 2/20 | 0.40 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.39 |
| ▸ | FKBP5 | Q13451 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | TOP2A | P11388 | 1/20 | 0.31 |
| ▸ | TOP2B | Q02880 | 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 | |
|---|---|---|---|---|
| SCHEMBL4455443 | 1.00 | CRBN (0.40) | CRBNOR51E2FKBP5POLBTOP2A | |
| SCHEMBL5567344 | 0.83 | — | — | |
| SCHEMBL2603220 | 0.81 | TSHR (0.34) | CRBNOR51E2FKBP5TOP2ATOP2B | |
| SCHEMBL2603211 | 0.81 | CRBN (0.36) | CRBNOR51E2FKBP5POLB | |
| SCHEMBL14749813 | 0.81 | CRBN (0.36) | CRBNOR51E2FKBP5POLB | |
| SCHEMBL24456537 | 0.81 | TSHR (0.34) | CRBNOR51E2FKBP5TOP2ATOP2B | |
| SCHEMBL24567762 | 0.81 | TSHR (0.34) | CRBNOR51E2FKBP5TOP2ATOP2B | |
| SCHEMBL15215529 | 0.81 | CRBN (0.36) | CRBNOR51E2FKBP5POLB | |
| SCHEMBL11921331 | 0.80 | TSHR (0.35) | CRBNOR51E2FKBP5 | |
| SCHEMBL7624792 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3524599-A1 | PYRAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF | Japan Tobacco Inc. (JP) | 2019-08-14 | — | — | EP | disclosed |
| WO-2013031922-A1 | PYRAZOLE COMPOUND AND USE THEREOF FOR MEDICAL PURPOSES | 日本たばこ産業株式会社 (JP) | 2013-03-07 | — | — | WO | disclosed |