Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 5/20 | 0.44 |
| ▸ | CCR8 | P51685 | 5/20 | 0.44 |
| ▸ | CCR5 | P51681 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MMP2 | P08253 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | GMNN | O75496 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 1/20 | 0.44 |
| ▸ | THPO | P40225 | 1/20 | 0.44 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL21622822 | 0.94 | PIM1 (0.41) | CCR1CCR8CCR5MAPTLMNA | |
| SCHEMBL21622503 | 0.93 | CCR1 (0.38) | CCR1CCR8CCR5MAPTLMNA | |
| SCHEMBL16629661 | 0.93 | HTT (0.38) | CCR1CCR8CCR5MAPTLMNA | |
| SCHEMBL21622500 | 0.92 | KDM4E (0.37) | CCR1CCR8CCR5MAPTLMNA | |
| SCHEMBL21622577 | 0.91 | ALOX5 (0.40) | CCR1CCR8CCR5MAPTLMNA | |
| SCHEMBL21622684 | 0.91 | HCRTR1 (0.40) | CCR1CCR8CCR5MAPTLMNA | |
| SCHEMBL21622506 | 0.90 | MAPT (0.40) | CCR1CCR8CCR5MAPTLMNA | |
| SCHEMBL24926017 | 0.89 | BRD4 (0.38) | CCR1CCR8CCR5MAPTLMNA | |
| SCHEMBL24926020 | 0.89 | MAPT (0.38) | CCR1CCR8CCR5MAPTLMNA | |
| SCHEMBL24927081 | 0.89 | GRM4 (0.36) | CCR1CCR8CCR5MAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3820965-B1 | MATERIALS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2023-01-25 | — | — | EP | disclosed |
| WO-2020011658-A1 | MATERIALS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH (DE) | 2020-01-16 | — | — | WO | disclosed |