Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 8/20 | 0.34 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.33 |
| ▸ | GABRE | P78334 | 1/20 | 0.33 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.33 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20679549 | 0.76 | GABRP (0.39) | KDM4EALDH1A1LMNAGAAL3MBTL1 | |
| SCHEMBL30675575 | 0.76 | GABRP (0.39) | KDM4EALDH1A1LMNAGAAL3MBTL1 | |
| SCHEMBL23024997 | 0.74 | NOS3 (0.38) | GABRPGABRDGABRA1GABRB1GABRG2 | |
| SCHEMBL172083 | 0.71 | EGLN2 (0.43) | KDM4EALDH1A1LMNAGAAL3MBTL1 | |
| SCHEMBL23458888 | 0.71 | HTT (0.46) | KDM4EALDH1A1LMNAGAAL3MBTL1 | |
| SCHEMBL18036224 | 0.71 | EGLN2 (0.37) | KDM4EALDH1A1LMNAGAAL3MBTL1 | |
| SCHEMBL23024893 | 0.71 | TDP1 (0.35) | PIK3CD | |
| SCHEMBL20687499 | 0.70 | GABRP (0.33) | KDM4EALDH1A1LMNAGAAL3MBTL1 | |
| SCHEMBL25778172 | 0.68 | CSNK1A1 (0.38) | KDM4EALDH1A1LMNAGAAL3MBTL1 | |
| SCHEMBL25958323 | 0.68 | EGLN2 (0.33) | CHEK1GABRPGABRDGABRA1GABRB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3870582-B1 | 5-AZAINDAZOLE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS | MERCK PATENT GMBH (DE) | 2023-07-19 | — | — | EP | disclosed |