Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.38 |
| ▸ | DHODH | Q02127 | 5/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | EEF2K | O00418 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | UGCG | Q16739 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.30 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.30 |
| ▸ | MERTK | Q12866 | 1/20 | 0.30 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.30 |
| ▸ | PPARD | Q03181 | 1/20 | 0.30 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL8558376 | 1.00 | ESR1 (0.38) | ESR1ESR2DHODHCNR1CNR2 | |
| SCHEMBL7478828 | 0.85 | ESR1 (0.38) | ESR1ESR2CNR1CNR2HDAC6 | |
| SCHEMBL7478822 | 0.85 | ESR1 (0.38) | ESR1ESR2CNR1CNR2HDAC6 | |
| SCHEMBL8566561 | 0.85 | ESR1 (0.38) | ESR1ESR2BACE1HDAC6TYRO3 | |
| SCHEMBL8566564 | 0.85 | ESR1 (0.38) | ESR1ESR2BACE1HDAC6TYRO3 | |
| SCHEMBL8562237 | 0.81 | ESR1 (0.39) | ESR1ESR2BACE1HDAC6ABHD6 | |
| SCHEMBL8562233 | 0.81 | ESR1 (0.39) | ESR1ESR2BACE1HDAC6ABHD6 | |
| SCHEMBL8566943 | 0.80 | PPARD (0.33) | DHODHPOLBPPARDPPARA | |
| SCHEMBL8566938 | 0.80 | PPARD (0.33) | DHODHPOLBPPARDPPARA | |
| SCHEMBL8567428 | 0.80 | ESR1 (0.40) | ESR1ESR2HDAC6TYRO3MERTK |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0612741-B1 | Cyclic derivatives, medicaments containing them and process for their preparation | THOMAE GMBH DR K (DE) | 1998-06-10 | — | — | EP | disclosed |
| US-5612335-A | ANTICOAGULANTS; COMBATING/PREVENTING DISEASES WHERE CELL AGGREGATES OCCUR OR CELL-MATRIX INTERACTIONS PLAY A PART | KARL THOMAE GMBH (DE) | 1997-03-18 | — | — | US | disclosed |
| US-5519036-A | IMIDAZOLIDINONES, ANTICOAGULANTS, CELL AGGREGATION PREVENTION | KARL THOMAE GMBH (DE) | 1996-05-21 | — | — | US | disclosed |
| EP-0612741-A1 | Cyclic derivatives, medicaments containing them and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1994-08-31 | — | — | EP | disclosed |