Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.71 |
| ▸ | NPC1 | O15118 | 4/20 | 0.71 |
| ▸ | RAB9A | P51151 | 4/20 | 0.71 |
| ▸ | LMNA | P02545 | 4/20 | 0.71 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.71 |
| ▸ | HPGD | P15428 | 2/20 | 0.71 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.71 |
| ▸ | TP53 | P04637 | 1/20 | 0.71 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.44 |
| ▸ | APAF1 | O14727 | 1/20 | 0.44 |
| ▸ | AHR | P35869 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | TDO2 | P48775 | 1/20 | 0.44 |
| ▸ | IDO2 | Q6ZQW0 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL24513437 | 0.90 | NPC1 (0.71) | KDM4ENPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL26227965 | 0.84 | LMNA (0.59) | KDM4ENPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL24513330 | 0.84 | NPC1 (0.49) | KDM4ENPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL12289816 | 0.83 | KDM4E (1.00) | KDM4ENPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL25256921 | 0.83 | RAB9A (0.60) | KDM4ENPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL29379145 | 0.83 | RAB9A (0.60) | KDM4ENPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL16441919 | 0.82 | RAB9A (0.48) | KDM4ENPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL26228076 | 0.82 | SMN1; SMN2 (0.59) | KDM4ENPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL24513314 | 0.81 | KDM4E (0.66) | KDM4ENPC1RAB9ALMNASMN1; SMN2 | |
| SCHEMBL24513353 | 0.78 | LMNA (0.55) | KDM4ENPC1RAB9ALMNASMN1; SMN2 |
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-2022122682-A2 | MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2022-06-16 | — | — | WO | disclosed |