Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | BRD4 | O60885 | 4/20 | 0.35 |
| ▸ | PARP1 | P09874 | 2/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | DHODH | Q02127 | 1/20 | 0.31 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.31 |
| ▸ | KDR | P35968 | 1/20 | 0.30 |
| ▸ | CFTR | P13569 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | AURKA | O14965 | 1/20 | 0.30 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.30 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL17273902 | 0.81 | KMT2A (0.70) | KMT2AKDM4EMEN1CYP1A2CYP3A4 | |
| SCHEMBL30625698 | 0.73 | KDM4E (0.83) | KMT2AKDM4EMEN1CYP1A2CYP3A4 | |
| SCHEMBL2583091 | 0.71 | CYP2C9 (1.00) | KMT2AKDM4EMEN1CYP1A2CYP3A4 | |
| SCHEMBL30516131 | 0.71 | CYP2C9 (1.00) | KMT2AKDM4EMEN1CYP1A2CYP3A4 | |
| SCHEMBL22173221 | 0.57 | MAPT (0.68) | KMT2AKDM4EMEN1CYP1A2CYP3A4 | |
| SCHEMBL25835280 | 0.57 | ERCC1 (0.50) | KMT2AKDM4EMEN1CYP1A2CYP3A4 | |
| SCHEMBL20227594 | 0.55 | PARP1 (0.63) | KMT2AKDM4EMEN1CYP1A2PARP1 | |
| SCHEMBL21636104 | 0.55 | PARP1 (0.63) | KMT2AKDM4EMEN1CYP1A2PARP1 | |
| SCHEMBL30625697 | 0.55 | TP53 (0.55) | KMT2AKDM4EMEN1CYP1A2CYP3A4 | |
| SCHEMBL14933432 | 0.54 | PARP1 (0.62) | KMT2AKDM4EMEN1CYP1A2BRD4 |
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 |
|---|---|---|---|---|---|---|---|
| US-9879058-B2 | Use of compounds that selectively modulate astrocytic release of substances through hemichannels of connexins and pannexins, without influencing gap junctions, for the treatment of psychiatric disorders | UNIVERSIDAD ANDRES BELLO (CL) | 2018-01-30 | — | — | US | disclosed |
| US-20150337018-A1 | USE OF COMPOUNDS THAT SELECTIVELY MODULATE ASTROCYTIC RELEASE OF SUBSTANCES THROUGH HEMICHANNELS OF CONNEXINS AND PANNEXINS, WITHOUT INFLUENCING GAP JUNCTIONS, FOR THE TREATMENT OF PSYCHIATRIC DISORDERS | UNIVERSIDAD ANDRES BELLO (CL) | 2015-11-26 | — | — | US | disclosed |