Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.51 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.51 |
| ▸ | ABHD6 | Q9BV23 | 4/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | TYRO3 | Q06418 | 2/20 | 0.39 |
| ▸ | MERTK | Q12866 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | TMPRSS2 | O15393 | 1/20 | 0.39 |
| ▸ | KCNA1 | Q09470 | 1/20 | 0.38 |
| ▸ | KCNAB1 | Q14722 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7471562 | 0.78 | ESR1 (0.50) | ESR1ESR2ABHD6HDAC6TYRO3 | |
| SCHEMBL719483 | 0.78 | ESR1 (0.52) | ESR1ESR2HDAC6KCNA1KCNAB1 | |
| SCHEMBL2309023 | 0.75 | ESR1 (0.85) | ESR1ESR2ABHD6HDAC6KCNA1 | |
| SCHEMBL8559726 | 0.74 | ESR1 (0.46) | ESR1ESR2ABHD6HDAC6TYRO3 | |
| SCHEMBL7418167 | 0.74 | ESR1 (0.46) | ESR1ESR2HDAC6TYRO3MERTK | |
| SCHEMBL4075352 | 0.73 | ESR1 (0.52) | ESR1ESR2ABHD6HDAC6KDM4E | |
| SCHEMBL1957429 | 0.73 | KCNA1 (0.57) | ESR1ESR2KDM4EKCNA1KCNAB1 | |
| SCHEMBL1787935 | 0.71 | ESR1 (0.53) | ESR1ESR2ABHD6HDAC6 | |
| SCHEMBL1787934 | 0.71 | ESR1 (0.53) | ESR1ESR2ABHD6HDAC6 | |
| SCHEMBL373697 | 0.71 | ESR2 (0.83) | ESR1ESR2ABHD6HDAC6 |
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-0777667-A1 | CYCLIC BENZAZEPINE UREA DERIVATIVES WITH AGGREGATION-INHIBITING EFFECT | Dr. Karl Thomae GmbH (DE) | 1997-06-11 | — | — | EP | disclosed |
| WO-1996005194-A1 | CYCLIC BENZAZEPINE UREA DERIVATIVES WITH AGGREGATION-INHIBITING EFFECT | DR. KARL THOMAE GMBH (DE) | 1996-02-22 | — | — | WO | disclosed |