Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 6/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | MAPT | P10636 | 5/20 | 0.35 |
| ▸ | HPGD | P15428 | 5/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.33 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.32 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL17486208 | 0.93 | MEN1 (0.34) | MEN1KMT2AALDH1A1MAPTHPGD | |
| SCHEMBL17486349 | 0.93 | KDM4E (0.37) | MEN1KMT2AALDH1A1MAPTHPGD | |
| SCHEMBL17486350 | 0.90 | CYP2A6 (0.39) | MAPTNPC1RAB9ASMN1; SMN2CYP2C19 | |
| SCHEMBL17486202 | 0.87 | RARG (0.35) | MEN1KMT2AALDH1A1MAPTHPGD | |
| SCHEMBL17486212 | 0.87 | MEN1 (0.34) | MEN1KMT2AALDH1A1MAPTHPGD | |
| SCHEMBL17486251 | 0.85 | — | — | |
| SCHEMBL17486354 | 0.84 | CYP1A2 (0.41) | NPC1ALOX5APFEN1 | |
| SCHEMBL17486352 | 0.84 | DGAT1 (0.32) | MAPT | |
| SCHEMBL17486353 | 0.83 | SMN1; SMN2 (0.35) | MEN1KMT2AALDH1A1MAPTHPGD | |
| SCHEMBL17486227 | 0.82 | HSD17B1 (0.41) | MEN1KMT2AALDH1A1MAPTHPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016015815-A1 | METAL COMPLEXES | MERCK PATENT GMBH (DE) | 2016-02-04 | — | — | WO | disclosed |