Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | APEX1 | P27695 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CTSL | P07711 | 5/20 | 0.42 |
| ▸ | CTSS | P25774 | 5/20 | 0.42 |
| ▸ | CTSK | P43235 | 5/20 | 0.42 |
| ▸ | CTSB | P07858 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6443757 | 0.90 | KDM4E (0.47) | KDM4ETAAR1KMT2AAPEX1CYP1A2 | |
| SCHEMBL6442378 | 0.87 | GAA (0.47) | KMT2ACTSLCTSSCTSKCTSB | |
| SCHEMBL6447899 | 0.85 | CTSL (0.54) | CTSLCTSSCTSKCTSB | |
| SCHEMBL6447040 | 0.84 | CTSD (0.49) | KDM4EKMT2AHTTCTSBMEN1 | |
| SCHEMBL6442268 | 0.82 | KDM4E (0.58) | KDM4ETAAR1KMT2AAPEX1CYP1A2 | |
| SCHEMBL6446549 | 0.81 | KDM4E (0.50) | KDM4ETAAR1KMT2AAPEX1CYP1A2 | |
| SCHEMBL6020733 | 0.78 | CTSL (0.53) | CTSLCTSSCTSKCTSB | |
| SCHEMBL6449654 | 0.78 | CTSK (0.56) | KDM4ETAAR1KMT2AAPEX1CYP1A2 | |
| SCHEMBL5177699 | 0.77 | KDM4E (0.59) | KDM4ETAAR1KMT2AAPEX1CYP1A2 | |
| SCHEMBL6822581 | 0.77 | GAA (0.43) | KDM4EKMT2AMEN1 |
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-1575903-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | Jerini AG (DE) | 2005-09-21 | — | — | EP | claimed |
| WO-2004065353-A1 | COMPOUNDS FOR THE INHIBITION OF ROTAMASES | JERINI AG (DE) | 2004-08-05 | — | — | WO | claimed |
| WO-2004056755-A2 | COMPOUNDS FOR THE INHIBITION OF NON-PROTEOLYTIC ENZYMES | JERENI AG (DE) | 2004-07-08 | — | — | WO | disclosed |