Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.59 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.56 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | BLM | P54132 | 1/20 | 0.54 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.54 |
| ▸ | TRPV1 | Q8NER1 | 5/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL28664897 | 0.85 | THRA (0.59) | HPGD | |
| SCHEMBL28659138 | 0.85 | THRA (0.59) | HPGD | |
| SCHEMBL9858533 | 0.84 | ESR1 (0.46) | — | |
| SCHEMBL9858553 | 0.84 | ESR1 (0.46) | — | |
| SCHEMBL8417025 | 0.84 | ESR1 (0.46) | — | |
| SCHEMBL28541651 | 0.83 | CYP1A2 (0.61) | KDM4EPOLBHDAC6CYP1A2CYP3A4 | |
| SCHEMBL20476155 | 0.83 | CYP1A2 (0.61) | KDM4EPOLBHDAC6CYP1A2CYP3A4 | |
| SCHEMBL22390229 | 0.82 | CYP1A2 (0.59) | KDM4EPOLBHSD17B2CYP1A2CYP3A4 | |
| SCHEMBL22655275 | 0.81 | HSD17B3 (0.51) | CYP1A2CYP2C19ALDH1A1CYP2D6 | |
| SCHEMBL9016067 | 0.81 | HSD17B3 (0.51) | CYP1A2CYP2C19ALDH1A1CYP2D6 |
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-2424872-A1 | NEUROPROTECTIVE COMPOUNDS AND THEIR USE | The MCW Research Foundation, Inc. (US) | 2012-03-07 | — | — | EP | disclosed |
| WO-2010126719-A1 | NEUROPROTECTIVE COMPOUNDS AND THEIR USE | MCW RESEARCH FOUNDATION, INC. (US) | 2010-11-04 | — | — | WO | disclosed |