Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 2/20 | 0.50 |
| ▸ | IL1RN | P18510 | 1/20 | 0.50 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8419064 | 0.88 | LMNA (0.59) | KEAP1ALDH1A1POLBTSHRSMN1; SMN2 | |
| SCHEMBL30026801 | 0.88 | LMNA (0.59) | KEAP1ALDH1A1POLBTSHRSMN1; SMN2 | |
| SCHEMBL12945231 | 0.84 | PTGES2 (0.56) | ALDH1A1POLBTSHRMEN1KMT2A | |
| SCHEMBL12945230 | 0.84 | KEAP1 (0.60) | KEAP1ALDH1A1SMN1; SMN2KMT2AMAPT | |
| SCHEMBL12945236 | 0.84 | CA2 (0.57) | ALDH1A1POLBTSHRSMN1; SMN2MEN1 | |
| SCHEMBL12945621 | 0.81 | KEAP1 (0.61) | KEAP1 | |
| SCHEMBL12945429 | 0.81 | SLC40A1 (0.46) | KEAP1IL1RNERAP1ALDH1A1POLB | |
| SCHEMBL5130307 | 0.80 | GABRA1 (0.41) | ALDH1A1POLBTSHRSMN1; SMN2MEN1 | |
| SCHEMBL8420054 | 0.80 | KEAP1 (0.46) | KEAP1ALDH1A1KMT2AKDM4E | |
| SCHEMBL10272404 | 0.80 | ALDH1A1 (0.71) | KEAP1IL1RNERAP1ALDH1A1POLB |
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-112479968-B | Synthetic method for preparing 2-methylpyrrolidine compound by catalyzing hydroamination reaction | 南通大学 | 2021-11-12 | — | — | CN | claimed |