Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH2 | P48735 | 2/20 | 0.43 |
| ▸ | METAP2 | P50579 | 2/20 | 0.41 |
| ▸ | ITGB2 | P05107 | 3/20 | 0.40 |
| ▸ | ICAM1 | P05362 | 3/20 | 0.40 |
| ▸ | ITGAL | P20701 | 3/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 2/20 | 0.39 |
| ▸ | TACR3 | P29371 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | SCD | O00767 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL25459805 | 1.00 | IDH2 (0.43) | IDH2METAP2ITGB2ICAM1ITGAL | |
| SCHEMBL30085808 | 1.00 | IDH2 (0.43) | IDH2METAP2ITGB2ICAM1ITGAL | |
| SCHEMBL30085769 | 0.87 | HRH4 (0.45) | MEN1ALDH1A1MAPTKMT2AKDM4E | |
| SCHEMBL28894888 | 0.87 | HRH4 (0.45) | MEN1ALDH1A1MAPTKMT2AKDM4E | |
| SCHEMBL25458547 | 0.87 | HRH4 (0.45) | MEN1ALDH1A1MAPTKMT2AKDM4E | |
| SCHEMBL25458420 | 0.84 | KDM4E (0.47) | ITGB2ICAM1ITGALHSD17B10MEN1 | |
| SCHEMBL25460015 | 0.83 | MAP3K12 (0.42) | MAPK1HSD17B10SCDSCN9A | |
| SCHEMBL30085868 | 0.83 | CTSK (0.48) | IDH2METAP2ITGB2ICAM1ITGAL | |
| SCHEMBL28895224 | 0.83 | CTSK (0.48) | IDH2METAP2ITGB2ICAM1ITGAL | |
| SCHEMBL28895222 | 0.83 | CTSK (0.48) | IDH2METAP2ITGB2ICAM1ITGAL |
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-115397818-A | Aminopyrimidine derivatives and their use as modulators of arene receptors | 东亚ST株式会社 | 2022-11-25 | — | — | CN | disclosed |