Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | USP2 | O75604 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | CLK1 | P49759 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | CD74 | P04233 | 1/20 | 0.32 |
| ▸ | MIF | P14174 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21847283 | 0.79 | ALDH1A1 (0.39) | BRD4P2RX7CYP2C19MEN1KMT2A | |
| SCHEMBL21847192 | 0.68 | BRD4 (0.39) | SMN1; SMN2BRD4CYP2D6ALDH1A1USP2 | |
| SCHEMBL21847101 | 0.66 | BRD4 (0.41) | BRD4CYP2D6CYP2C19MEN1KMT2A | |
| SCHEMBL21847138 | 0.66 | BRD4 (0.46) | BRD4 | |
| SCHEMBL21847285 | 0.65 | BRD4 (0.43) | SMN1; SMN2BRD4ALDH1A1USP2LMNA | |
| SCHEMBL8319389 | 0.65 | BRD4 (0.46) | BRD4P2RX7CYP2D6LMNA | |
| SCHEMBL21847118 | 0.62 | P2RX7 (0.38) | BRD4P2RX7 | |
| SCHEMBL21847113 | 0.61 | BRD4 (0.37) | BRD4ALDH1A1 | |
| SCHEMBL21847104 | 0.60 | PDE4B (0.40) | BRD4CYP2D6CYP2C19MEN1KMT2A | |
| SCHEMBL21847182 | 0.59 | BRD4 (0.41) | SMN1; SMN2BRD4CYP2D6LMNATSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3640253-A1 | 6H-THIENO[2,3-E][1,2,4]TRIAZOLO[3,4-C][1,2,4]TRIAZEPINE DERIVATIVE | AYUMI Pharmaceutical Corporation (JP) | 2020-04-22 | — | — | EP | disclosed |