Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 5/20 | 0.44 |
| ▸ | CCR8 | P51685 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 5/20 | 0.44 |
| ▸ | CCR5 | P51681 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MMP2 | P08253 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 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 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | MMP8 | P22894 | 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 | |
|---|---|---|---|---|
| SCHEMBL21622565 | 0.95 | CCR1 (0.40) | CCR1CCR8LMNACCR5KDM4E | |
| SCHEMBL21622474 | 0.94 | LMNA (0.41) | CCR1CCR8LMNACCR5KDM4E | |
| SCHEMBL21622842 | 0.94 | LIMK1 (0.41) | CCR1CCR8LMNACCR5KDM4E | |
| SCHEMBL21622641 | 0.92 | LMNA (0.40) | CCR1CCR8LMNACCR5KDM4E | |
| SCHEMBL21622520 | 0.90 | LMNA (0.41) | CCR1CCR8LMNACCR5KDM4E | |
| SCHEMBL21622507 | 0.90 | ALDH1A1 (0.41) | CCR1CCR8LMNACCR5KDM4E | |
| SCHEMBL21622617 | 0.89 | ALDH1A1 (0.40) | CCR1CCR8LMNACCR5KDM4E | |
| SCHEMBL21622522 | 0.89 | LMNA (0.40) | CCR1CCR8LMNACCR5KDM4E | |
| SCHEMBL21622521 | 0.89 | LMNA (0.40) | CCR1CCR8LMNACCR5KDM4E | |
| SCHEMBL21622683 | 0.85 | CCR1 (0.41) | CCR1CCR8LMNACCR5KDM4E |
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 |