Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 1/20 | 0.40 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.40 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.39 |
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.36 |
| ▸ | CHUK | O15111 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 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 | |
|---|---|---|---|---|
| SCHEMBL31122401 | 1.00 | NR3C1 (0.40) | NR3C1PGRNR3C2ARPIM3 | |
| SCHEMBL30456277 | 0.83 | KEAP1 (0.51) | NR3C1PGRNR3C2ARKDM4E | |
| SCHEMBL1162240 | 0.78 | KDM4E (0.42) | PIM3PIM1KDM4EBCHEKEAP1 | |
| SCHEMBL12869670 | 0.78 | NR4A2 (0.42) | PIM3PIM1KDM4EBCHEKEAP1 | |
| SCHEMBL14559837 | 0.77 | TNF (0.46) | PIM3PIM1KDM4ESMN1; SMN2BCHE | |
| SCHEMBL23551487 | 0.77 | PIM3 (0.41) | PIM3PIM1KDM4ESMN1; SMN2BCHE | |
| SCHEMBL24308142 | 0.77 | CHEK1 (0.45) | PIM3PIM1KDM4EBCHEKEAP1 | |
| SCHEMBL987448 | 0.75 | IKBKB (0.43) | PIM3PIM1KDM4ESMN1; SMN2HSD17B10 | |
| SCHEMBL25362273 | 0.73 | ALDH1A1 (0.43) | PIM3PIM1KDM4EHSD17B10BCHE | |
| SCHEMBL31122414 | 0.73 | PIM3 (0.41) | PIM3PIM1KDM4EHSD17B10BCHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118647607-A | Pyrimidine heterocyclic compounds, process for preparing the same and pharmaceutical use thereof | 英矽智能科技(上海)有限公司 | 2024-09-13 | — | — | CN | disclosed |
| WO-2023116761-A1 | PYRIMIDINE HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE | 英矽智能科技知识产权有限公司 | 2023-06-29 | — | — | WO | disclosed |