Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.51 |
| ▸ | KMO | O15229 | 1/20 | 0.44 |
| ▸ | DHFR | P00374 | 1/20 | 0.44 |
| ▸ | KIT | P10721 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.42 |
| ▸ | FYN | P06241 | 3/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21721927 | 0.85 | NPC1 (0.48) | KDM1AL3MBTL1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL23956242 | 0.84 | KDM1A (0.51) | KDM1AKMODHFRKITFYN | |
| SCHEMBL21290360 | 0.81 | NPC1 (0.42) | KDM1ADHFRKITS1PR1PDE4D | |
| SCHEMBL21290361 | 0.81 | POLB (0.43) | KDM1AKITS1PR1FYNL3MBTL1 | |
| SCHEMBL21290349 | 0.80 | KDM1A (0.58) | KDM1AKMODHFRS1PR1FYN | |
| SCHEMBL21290362 | 0.80 | TP53 (0.53) | KDM1AFYNMAPT | |
| SCHEMBL19933811 | 0.78 | HSD17B1 (0.53) | KDM1AL3MBTL1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL23239937 | 0.78 | KDM1A (0.47) | KDM1AKMONPC1RAB9ASMN1; SMN2 | |
| SCHEMBL19933810 | 0.78 | ALDH1A1 (0.50) | L3MBTL1NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL20068872 | 0.76 | MAPK1 (0.52) | L3MBTL1NPC1RAB9ASMN1; SMN2MAPT |
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 |