Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 9/20 | 0.50 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 2/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | PRMT3 | O60678 | 1/20 | 0.36 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30241134 | 0.97 | EGFR (0.50) | EGFRBACE1ABL1CYP11B2PDGFRB | |
| SCHEMBL28110106 | 0.86 | EGFR (0.46) | EGFRTDO2HRH3 | |
| SCHEMBL22288192 | 0.71 | ALDH1A1 (0.49) | BACE1ABL1CYP11B2HTTKMT2A | |
| SCHEMBL8641138 | 0.70 | EGFR (0.64) | EGFRKDM4ETDO2IMPDH2 | |
| SCHEMBL4971125 | 0.70 | BACE1 (0.50) | BACE1ABL1CYP11B2HTTKMT2A | |
| SCHEMBL6992354 | 0.70 | EGFR (0.58) | EGFRABL1PDGFRBPDGFRA | |
| SCHEMBL28452949 | 0.69 | BACE1 (0.49) | BACE1ABL1CYP11B2HTTSMN1; SMN2 | |
| SCHEMBL22777973 | 0.69 | BACE1 (0.49) | BACE1ABL1HRH3 | |
| SCHEMBL22288360 | 0.69 | BACE1 (0.49) | BACE1ABL1CYP11B2PRMT3HRH3 | |
| SCHEMBL3823024 | 0.69 | CYP11B2 (0.50) | CYP11B2PDGFRBPDGFRAKDM4EGLA |
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-1356990-A | Bicyclic heterocyclic compounds, pharmaceutical compositions containing them, use of the compounds and process for their preparation | BOEHRINGER INGELHEIM PHARMA (DE) | 2002-07-03 | — | — | CN | disclosed |