Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HTR1B | P28222 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HTR1D | P28221 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL7216512 | 0.82 | MAPT (0.52) | CNR1CNR2CYP2A6MAPTNPSR1 | |
| SCHEMBL26586938 | 0.81 | KDM4E (0.37) | CNR1CNR2MAPTNPSR1L3MBTL1 | |
| SCHEMBL16955136 | 0.81 | PDCD1 (0.44) | CNR1CNR2MCHR1CYP2A6MAPT | |
| SCHEMBL1135286 | 0.79 | PTPN1 (0.39) | SLC6A2SLC6A4 | |
| SCHEMBL16962845 | 0.79 | MAPT (0.42) | CNR1CNR2MCHR1CYP2A6MAPT | |
| SCHEMBL16959265 | 0.79 | NPC1 (0.42) | CNR1CNR2MCHR1CYP2A6MAPT | |
| SCHEMBL16952926 | 0.79 | MCHR1 (0.40) | CNR1CNR2MCHR1CYP2A6MAPT | |
| SCHEMBL16962193 | 0.79 | MCHR1 (0.40) | CNR1CNR2MCHR1CYP2A6MAPT | |
| SCHEMBL1907925 | 0.78 | PDE4A (0.44) | MAPTL3MBTL1SLC6A2SLC6A4TP53 | |
| SCHEMBL16950723 | 0.78 | L3MBTL1 (0.45) | CNR1CNR2MCHR1CYP2A6MAPT |
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-0817782-B1 | PHENYL DERIVATIVES USEFUL AS ENDOTHELIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 2002-09-25 | — | — | EP | disclosed |
| US-6147111-A | KIDNEY, BRAIN, AND CARDIOVASCULAR DISORDERS; VASODILATION | SMITHKLINE BEECHAM P.L.C. (GB) | 2000-11-14 | — | — | US | disclosed |
| EP-0817782-A1 | PHENYL DERIVATIVES USEFUL AS ENDOTHELIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1998-01-14 | — | — | EP | disclosed |
| WO-1996030358-A1 | PHENYL DERIVATIVES USEFUL AS ENDOTHELIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM PLC (GB) | 1996-10-03 | — | — | WO | disclosed |