Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | DHFR | P00374 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL29833216 | 0.80 | MAPT (0.46) | ALDH1A1MEN1KMT2AMAPK1 | |
| SCHEMBL28171948 | 0.79 | FAAH (0.41) | MGLLALDH1A1MEN1KMT2AALOX5 | |
| SCHEMBL2049800 | 0.77 | MAPT (0.33) | MEN1KMT2AMAPK1NPC1 | |
| SCHEMBL28066685 | 0.76 | ADRB1 (0.45) | MGLLALDH1A1MEN1KMT2AALOX5 | |
| Hydrochloric Acid SCHEMBL29103226 | 0.75 | NPC1 (0.35) | MEN1KMT2AMAPK1NPC1 | |
| Hydrochloric Acid SCHEMBL28920941 | 0.75 | NPC1 (0.35) | MEN1KMT2AMAPK1NPC1 | |
| Water SCHEMBL28778724 | 0.75 | MAPT (0.32) | MEN1KMT2AMAPK1NPC1 | |
| Bromide SCHEMBL27617008 | 0.75 | MAPT (0.32) | MEN1KMT2AMAPK1NPC1 | |
| SCHEMBL4140323 | 0.75 | MAPT (0.32) | MEN1KMT2AMAPK1NPC1 | |
| Bromobenzene SCHEMBL28160069 | 0.73 | HTT (0.39) | MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107973779-A | A kind of N-（2- pyridines/pyrimidine radicals）The preparation method of indole derivatives | 华侨大学 | 2018-05-01 | — | — | CN | disclosed |