Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.48 |
| ▸ | TDO2 | P48775 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23956334 | 0.92 | IDO1 (0.41) | IDO1TDO2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL21290347 | 0.86 | IDO1 (0.54) | IDO1TDO2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL18015464 | 0.81 | MAPK1 (0.55) | IDO1TDO2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL18015453 | 0.80 | LDHA (0.54) | IDO1TDO2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL21290360 | 0.80 | NPC1 (0.42) | IDO1TDO2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL23956277 | 0.79 | LDHA (0.47) | IDO1TDO2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL23956268 | 0.79 | IDO1 (0.47) | IDO1TDO2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL21142232 | 0.78 | MAPK1 (0.52) | IDO1TDO2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL21290147 | 0.78 | TP53 (0.49) | SMN1; SMN2NPC1RAB9AMAPTGAA | |
| SCHEMBL21290387 | 0.78 | IDO1 (0.46) | IDO1TDO2SMN1; SMN2NPC1RAB9A |
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 |