Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28084655 | 0.93 | ERN1 (0.36) | KDM4EMEN1ALDH1A1CYP1A2GLA | |
| SCHEMBL27785390 | 0.77 | ERN1 (0.47) | KDM4EMEN1ALDH1A1CYP1A2GLA | |
| SCHEMBL28084656 | 0.77 | KMT2A (0.36) | KDM4EMEN1ALDH1A1CYP1A2GLA | |
| SCHEMBL28767893 | 0.77 | PLAU (0.39) | KDM4EMEN1ALDH1A1CYP1A2GLA | |
| SCHEMBL27304277 | 0.75 | ALDH1A1 (0.53) | KDM4EMEN1ALDH1A1CYP1A2GLA | |
| SCHEMBL27661280 | 0.73 | ALDH1A1 (0.61) | KDM4EMEN1ALDH1A1CYP1A2GLA | |
| SCHEMBL28175642 | 0.73 | ERN1 (0.45) | KDM4EMEN1ALDH1A1CYP1A2GLA | |
| SCHEMBL28084657 | 0.73 | KMT2A (0.40) | KDM4EMEN1ALDH1A1CYP1A2GLA | |
| SCHEMBL27810256 | 0.72 | ALDH1A1 (0.59) | KDM4EMEN1ALDH1A1CYP1A2GLA | |
| SCHEMBL5427708 | 0.72 | ALDH1A1 (0.44) | KDM4EMEN1ALDH1A1CYP1A2GLA |
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 |
|---|---|---|---|---|---|---|---|
| CN-105837478-A | Bisulfonyl anthracenedione dioxime derivative serving as P2X<3> and P2X<2/3> receptor antagonists | 成都理工大学 | 2016-08-10 | — | — | CN | disclosed |