Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21978883 | 1.00 | ATM (0.43) | ATMMEN1HCRTR1KMT2AKDM4E | |
| SCHEMBL30901293 | 0.87 | ATM (0.50) | ATMKDM4EALDH1A1SMN1; SMN2TP53 | |
| SCHEMBL21979007 | 0.87 | ATM (0.50) | ATMKDM4EALDH1A1SMN1; SMN2TP53 | |
| SCHEMBL22035485 | 0.83 | EGFR (0.40) | MEN1KMT2AALDH1A1HPGDSRC | |
| SCHEMBL21978677 | 0.81 | RAB9A (0.41) | HCRTR1KDM4ETP53 | |
| SCHEMBL22016488 | 0.78 | ATM (0.41) | ATMMEN1HCRTR1KMT2AKDM4E | |
| SCHEMBL22035261 | 0.78 | ATM (0.41) | ATMMEN1HCRTR1KMT2AKDM4E | |
| SCHEMBL22017133 | 0.78 | HSP90AA1 (0.44) | ATMMEN1HCRTR1KMT2AKDM4E | |
| SCHEMBL21957282 | 0.77 | ATM (0.46) | ATMMEN1HCRTR1KMT2AKDM4E | |
| SCHEMBL31223914 | 0.77 | ATM (0.43) | ATMMEN1HCRTR1KMT2AKDM4E |
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-112969504-B | Compounds for inhibiting alpha 4 beta 7 integrin | 吉利德科学公司 | 2024-04-09 | — | — | CN | disclosed |