Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 7/20 | 0.68 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.68 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.68 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.68 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.68 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.61 |
| ▸ | ERN1 | O75460 | 1/20 | 0.60 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.54 |
| ▸ | ACACA | Q13085 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | CYP17A1 | P05093 | 4/20 | 0.50 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL5821959 | 0.85 | CYP1A2 (0.54) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL10591476 | 0.81 | FLT3 (0.54) | ACACAMEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL4214556 | 0.80 | CYP11B1 (0.78) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29501832 | 0.80 | CYP11B1 (0.78) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL8503236 | 0.78 | CYP11B1 (0.76) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL22575717 | 0.78 | TLR9 (1.00) | TLR9 | |
| SCHEMBL2203843 | 0.78 | CYP17A1 (0.58) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL29501876 | 0.77 | CYP11B1 (0.74) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7299965 | 0.76 | CYP11B1 (0.67) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL12767004 | 0.75 | ERN1 (1.00) | ERN1 |
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-105073744-B | Novel heterocyclic compounds as bromine structural domain inhibitor | ZENITH EPIGENETICS CORP. (CA) | 2019-11-08 | — | — | CN | disclosed |