Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 5/20 | 0.65 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.46 |
| ▸ | HPGDS | O60760 | 12/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | BAZ1A | Q9NRL2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27630991 | 0.85 | EGFR (0.64) | EGFRIMPDH2HPGDSNOTUM | |
| SCHEMBL7513856 | 0.83 | EGFR (0.61) | EGFRIMPDH2HPGDSNOTUMBAZ1A | |
| SCHEMBL6825418 | 0.82 | EGFR (0.59) | EGFRIMPDH2HPGDSNOTUMBAZ1A | |
| SCHEMBL29517021 | 0.79 | EGFR (1.00) | EGFRHPGDS | |
| SCHEMBL30241125 | 0.79 | EGFR (1.00) | EGFRHPGDS | |
| SCHEMBL668493 | 0.79 | EGFR (1.00) | EGFRHPGDS | |
| Hydrochloric Acid SCHEMBL28023744 | 0.78 | EGFR (0.96) | EGFRHPGDS | |
| SCHEMBL8414749 | 0.77 | CYP3A4 (0.51) | IMPDH2 | |
| SCHEMBL2944091 | 0.77 | KDM4E (0.47) | — | |
| SCHEMBL30507829 | 0.76 | CSNK2A1 (0.59) | EGFRIMPDH2NOTUM |
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 |
|---|---|---|---|---|---|---|---|
| EP-0927192-A1 | MODIFIED AMINOACIDS, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND METHOD FOR THEIR PRODUCTION | Dr. Karl Thomae GmbH (DE) | 1999-07-07 | — | — | EP | disclosed |
| WO-1998011128-A1 | MODIFIED AMINOACIDS, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND METHOD FOR THEIR PRODUCTION | DR. KARL THOMAE GMBH (DE) | 1998-03-19 | — | — | WO | disclosed |