Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FKBP1A | P62942 | 6/20 | 0.47 |
| ▸ | KLK7 | P49862 | 1/20 | 0.45 |
| ▸ | CTSL | P07711 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.43 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.43 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.43 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | JAK1 | P23458 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL21285649 | 1.00 | FKBP1A (0.47) | FKBP1AKLK7CTSLABCB1POLB | |
| SCHEMBL13967419 | 1.00 | FKBP1A (0.47) | FKBP1AKLK7CTSLABCB1POLB | |
| SCHEMBL9296386 | 0.91 | POLB (0.53) | FKBP1AKLK7CTSLABCB1POLB | |
| SCHEMBL1783541 | 0.91 | POLB (0.53) | FKBP1AKLK7CTSLABCB1POLB | |
| SCHEMBL1150829 | 0.91 | POLB (0.53) | FKBP1AKLK7CTSLABCB1POLB | |
| SCHEMBL1449334 | 0.91 | POLB (0.53) | FKBP1AKLK7CTSLABCB1POLB | |
| SCHEMBL1448453 | 0.91 | POLB (0.53) | FKBP1AKLK7CTSLABCB1POLB | |
| SCHEMBL17191527 | 0.91 | POLB (0.53) | FKBP1AKLK7CTSLABCB1POLB | |
| SCHEMBL2709081 | 0.91 | POLB (0.53) | FKBP1AKLK7CTSLABCB1POLB | |
| SCHEMBL4847623 | 0.91 | POLB (0.53) | FKBP1AKLK7CTSLABCB1POLB |
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-3256463-B1 | 1-(HET)ARYLSULFONYL-(PYRROLIDINE OR PIPERIDINE)-2-CARBOXAMIDE DERIVATIVES AND THEIR USE AS TRPA1 ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2019-10-09 | — | — | EP | disclosed |