Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.35 |
| ▸ | CTSK | P43235 | 2/20 | 0.34 |
| ▸ | CTSL | P07711 | 1/20 | 0.34 |
| ▸ | CTSS | P25774 | 1/20 | 0.34 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4047173 | 0.93 | SMYD3 (0.35) | SMYD3FKBP1AALDH1A1CYP2C9TSHR | |
| SCHEMBL4048306 | 0.93 | CTSK (0.38) | SMYD3CTSKCTSLCTSSALDH1A1 | |
| SCHEMBL4040745 | 0.90 | HSD17B10 (0.36) | SMYD3CTSKCTSLCTSSTSHR | |
| SCHEMBL4047756 | 0.89 | CTSL (0.38) | CTSKCTSLCTSSFKBP1A | |
| SCHEMBL4047237 | 0.88 | SMYD3 (0.35) | SMYD3CTSKCTSLCTSSFKBP1A | |
| SCHEMBL4047790 | 0.88 | CTSK (0.36) | CTSKCTSLCTSS | |
| SCHEMBL4049692 | 0.87 | CTSK (0.37) | CTSKCTSLCTSS | |
| SCHEMBL4050112 | 0.87 | CTSK (0.38) | CTSKF2ALDH1A1 | |
| SCHEMBL4047540 | 0.83 | CTSK (0.47) | CTSKCTSLCTSS | |
| SCHEMBL4045645 | 0.83 | SMYD3 (0.34) | SMYD3CTSKCTSLCTSSFKBP1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1546150-B1 | PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES | AMURA THERAPEUTICS LTD (GB) | 2009-03-04 | — | — | EP | claimed |
| EP-2031670-B1 | ORGANIC ELECTROLUMINESCENT DEVICE EMPLOYING HETEROCYCLE-CONTAINING ARYLAMINE DERIVATIVE | IDEMITSU KOSAN CO (JP) | 2013-11-27 | — | — | EP | disclosed |
| EP-2031670-A1 | ORGANIC ELECTROLUMINESCENT DEVICE EMPLOYING HETEROCYCLE-CONTAINING ARYLAMINE DERIVATIVE | Idemitsu Kosan Co., Ltd. (JP) | 2009-03-04 | — | — | EP | disclosed |