Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | PPM1B | O75688 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | PPP1CC | P36873 | 1/20 | 0.32 |
| ▸ | MIF | P14174 | 2/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL475660 | 0.80 | CYP1A2 (0.33) | CYP1A2HIF1APPM1BPTPN1PPP1CC | |
| SCHEMBL475658 | 0.80 | CYP1A2 (0.33) | CYP1A2HIF1APPM1BPTPN1PPP1CC | |
| SCHEMBL19386329 | 0.80 | CYP1A2 (0.33) | CYP1A2HIF1APPM1BPTPN1PPP1CC | |
| SCHEMBL14649971 | 0.80 | CYP1A2 (0.33) | CYP1A2HIF1APPM1BPTPN1PPP1CC | |
| SCHEMBL433180 | 0.78 | POLB (0.33) | CYP1A2HIF1APPM1BPTPN1PPP1CC | |
| SCHEMBL907524 | 0.78 | POLB (0.33) | CYP1A2HIF1APPM1BPTPN1PPP1CC | |
| SCHEMBL24664106 | 0.78 | POLB (0.33) | CYP1A2HIF1APPM1BPTPN1PPP1CC | |
| SCHEMBL31264948 | 0.78 | CYP2C19 (0.42) | CYP1A2HIF1ALMNA | |
| SCHEMBL12870929 | 0.78 | SMN1; SMN2 (0.32) | LMNA | |
| Hydrochloric Acid SCHEMBL31264976 | 0.77 | NOS3 (0.44) | LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022199587-A1 | PYRIMIDINE HETEROCYCLIC COMPOUND AND APPLICATION THEREOF | 南京明德新药研发有限公司 | 2022-09-29 | — | — | WO | disclosed |