Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 2/20 | 0.57 |
| ▸ | KMO | O15229 | 5/20 | 0.53 |
| ▸ | CCR1 | P32246 | 1/20 | 0.48 |
| ▸ | CCR5 | P51681 | 1/20 | 0.48 |
| ▸ | CCR8 | P51685 | 1/20 | 0.48 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.48 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL15345108 | 0.85 | RAB9A (0.56) | CCR1CCR5CCR8MEN1KMT2A | |
| SCHEMBL16385281 | 0.81 | RAB9A (0.57) | KMOCCR1CCR5CCR8MEN1 | |
| SCHEMBL24257876 | 0.80 | KMO (0.71) | DYRK1AKMOEGLN2MEN1KMT2A | |
| SCHEMBL21289970 | 0.79 | DYRK1A (0.55) | DYRK1AKMOKDM4CEGLN2MEN1 | |
| SCHEMBL21290163 | 0.78 | KMO (0.50) | DYRK1AKMOCCR1CCR5CCR8 | |
| SCHEMBL7241046 | 0.78 | ALDH1A1 (0.56) | CCR1CCR5CCR8MEN1KMT2A | |
| SCHEMBL14758456 | 0.76 | KMO (0.66) | DYRK1AKMOKDM4CEGLN2MEN1 | |
| SCHEMBL27849397 | 0.76 | DYRK1A (0.71) | DYRK1AKMOKDM4CEGLN2ALDH1A1 | |
| SCHEMBL4302847 | 0.75 | DYRK1A (0.65) | DYRK1AKMOEGLN2MEN1KMT2A | |
| SCHEMBL31695263 | 0.75 | CCR1 (0.76) | CCR1CCR5CCR8MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3752512-B1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2023-03-01 | — | — | EP | disclosed |
| EP-3601304-B1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2021-10-27 | — | — | EP | disclosed |
| WO-2019158453-A1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2019-08-22 | — | — | WO | disclosed |