Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 15/20 | 0.62 |
| ▸ | IDO1 | P14902 | 14/20 | 0.62 |
| ▸ | IDO2 | Q6ZQW0 | 13/20 | 0.62 |
| ▸ | NPC1 | O15118 | 2/20 | 0.62 |
| ▸ | RAB9A | P51151 | 2/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | LMNA | P02545 | 1/20 | 0.62 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.62 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.62 |
| ▸ | HTT | P42858 | 1/20 | 0.62 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.62 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.62 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.62 |
| ▸ | APAF1 | O14727 | 2/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | MITF | O75030 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL24513321 | 0.83 | TDO2 (0.50) | TDO2IDO1IDO2NPC1RAB9A | |
| SCHEMBL24513677 | 0.82 | TDO2 (0.62) | TDO2IDO1IDO2NPC1RAB9A | |
| SCHEMBL24513687 | 0.80 | TDO2 (0.48) | TDO2IDO1IDO2NPC1RAB9A | |
| SCHEMBL24513319 | 0.79 | TDO2 (0.60) | TDO2IDO1IDO2NPC1RAB9A | |
| Tryptanthrin SCHEMBL29359262 | 0.78 | TDO2 (1.00) | TDO2IDO1IDO2NPC1RAB9A | |
| Tryptanthrin SCHEMBL2426211 | 0.78 | TDO2 (1.00) | TDO2IDO1IDO2NPC1RAB9A | |
| SCHEMBL30537967 | 0.77 | TDO2 (0.74) | TDO2IDO1IDO2NPC1RAB9A | |
| SCHEMBL9103139 | 0.77 | TDO2 (0.74) | TDO2IDO1IDO2NPC1RAB9A | |
| SCHEMBL9101181 | 0.77 | TDO2 (0.74) | TDO2IDO1IDO2NPC1RAB9A | |
| SCHEMBL24513317 | 0.77 | TDO2 (0.58) | TDO2IDO1IDO2NPC1RAB9A |
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 |