Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.40 |
| ▸ | PGR | P06401 | 2/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.36 |
| ▸ | LPL | P06858 | 1/20 | 0.36 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.33 |
| ▸ | PARP1 | P09874 | 2/20 | 0.33 |
| ▸ | KDR | P35968 | 1/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | HTR1D | P28221 | 1/20 | 0.33 |
| ▸ | HTR1B | P28222 | 1/20 | 0.33 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 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 | |
|---|---|---|---|---|
| SCHEMBL7000241 | 0.84 | PARP1 (0.52) | KCNH2SLC6A11PGRPDE3BPDE3A | |
| SCHEMBL7000985 | 0.79 | KDM4E (0.54) | PGRPDE3BPDE3APARP1KDM4E | |
| SCHEMBL7711118 | 0.77 | KCNH2 (0.40) | KCNH2PGRPDE3BPDE3ALPL | |
| SCHEMBL7711311 | 0.73 | CYP11B1 (0.48) | PDE3BPDE3AKDR | |
| SCHEMBL7988135 | 0.72 | BRD4 (0.53) | PARP1MEN1GAAKMT2A | |
| SCHEMBL7711230 | 0.71 | PARP1 (0.37) | PDE3BPDE3APARP1 | |
| SCHEMBL7000474 | 0.71 | PARP1 (0.37) | PDE3BPDE3APARP1KDM4EMEN1 | |
| SCHEMBL6998842 | 0.71 | ACE2 (0.40) | PARP1PTGS1PTGS2KDM4EMEN1 | |
| SCHEMBL7003121 | 0.70 | KCNH2 (0.46) | KCNH2SLC6A11PGRLPLLIPG | |
| SCHEMBL7003125 | 0.68 | KCNH2 (0.48) | KCNH2PGRHDAC3HDAC1HDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6365736-B1 | TREATMENT OF NERVOUS SYSTEM DISORDERS, CARDIOVASCULAR DISORDERS AND FOR ACTIVITY AS NO-SYNTHASES (NOS) INHIBITORS. | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-04-02 | — | — | US | disclosed |