Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.32 |
| ▸ | MET | P08581 | 1/20 | 0.31 |
| ▸ | PRKDC | P78527 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.30 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.30 |
| ▸ | BACE1 | P56817 | 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 | |
|---|---|---|---|---|
| SCHEMBL23058310 | 0.95 | MET (0.34) | ALDH1A1KDM4EMEN1TP53CYP1A2 | |
| SCHEMBL23058531 | 0.95 | PTGER4 (0.34) | ALDH1A1KDM4EPTGER4BACE1 | |
| SCHEMBL23058281 | 0.94 | PTGER4 (0.33) | KDM4EPTGER4BACE1 | |
| SCHEMBL22916638 | 0.94 | ALDH1A1 (0.35) | ALDH1A1KDM4EMEN1TP53CYP1A2 | |
| SCHEMBL23058600 | 0.94 | PTGER4 (0.33) | KDM4ETP53PTGER4BACE1 | |
| SCHEMBL23058560 | 0.94 | PTGER4 (0.33) | PTGER4BACE1 | |
| SCHEMBL23058055 | 0.94 | PTGER4 (0.35) | PTGER4PRKDCBACE1 | |
| SCHEMBL24363571 | 0.93 | ALDH1A1 (0.33) | ALDH1A1KDM4EMEN1TP53CYP1A2 | |
| SCHEMBL23058356 | 0.93 | PLA2G2A (0.34) | PTGER4PRKDCBACE1 | |
| SCHEMBL24363427 | 0.93 | ALDH1A1 (0.35) | ALDH1A1KDM4EMEN1TP53CYP1A2 |
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-2021037401-A1 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2021-03-04 | — | — | WO | disclosed |