Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | TBK1 | Q9UHD2 | 3/20 | 0.34 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL3431023 | 0.82 | CXCR4 (0.37) | ATRHDAC8EGLN1 | |
| SCHEMBL3406962 | 0.80 | MEN1 (0.39) | ATRMEN1KMT2AKDM4ECYP1A2 | |
| SCHEMBL3410082 | 0.79 | MEN1 (0.35) | ATRMEN1KMT2AKDM4ECYP1A2 | |
| SCHEMBL3410075 | 0.70 | KMT2A (0.37) | ATRMEN1KMT2AKDM4ECYP1A2 | |
| SCHEMBL3406978 | 0.68 | SQOR (0.33) | ATRMEN1KMT2AKDM4ECYP1A2 | |
| SCHEMBL3407758 | 0.67 | LMNA (0.36) | ATRMEN1KMT2AKDM4ECYP1A2 | |
| SCHEMBL3408373 | 0.65 | HCRTR1 (0.34) | MEN1KMT2AKDM4ECYP1A2CYP2C19 | |
| SCHEMBL3408377 | 0.65 | SCN9A (0.34) | MEN1KMT2AKDM4ECYP1A2CYP2C19 | |
| SCHEMBL21816147 | 0.65 | ALDH1A1 (0.48) | ATRMEN1KMT2AKDM4EHCRTR1 | |
| SCHEMBL21438811 | 0.63 | ALDH1A1 (0.40) | ATRMEN1KMT2AKDM4EHCRTR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010038081-A2 | HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF | ASTRAZENECA AB (SE) | 2010-04-08 | — | — | WO | disclosed |