Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 14/20 | 0.62 |
| ▸ | NOS3 | P29474 | 9/20 | 0.62 |
| ▸ | NOS2 | P35228 | 6/20 | 0.56 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 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 | |
|---|---|---|---|---|
| SCHEMBL4692515 | 0.92 | NOS1 (0.60) | NOS1NOS3NOS2CHRNB2CHRNA4 | |
| SCHEMBL222693 | 0.92 | NOS1 (0.73) | NOS1NOS3NOS2CHRNB2CHRNA4 | |
| SCHEMBL218712 | 0.90 | NOS1 (0.65) | NOS1NOS3NOS2CHRNB2CHRNA4 | |
| SCHEMBL4296010 | 0.86 | NOS1 (0.57) | NOS1NOS3NOS2CHRNB2CHRNA4 | |
| SCHEMBL6585604 | 0.85 | NOS1 (0.61) | NOS1NOS3NOS2CHRNB2CHRNA4 | |
| SCHEMBL218649 | 0.83 | NOS1 (0.54) | NOS1NOS3NOS2CHRNB2CHRNA4 | |
| SCHEMBL220285 | 0.82 | NOS1 (0.61) | NOS1NOS3NOS2CHRNB2CHRNA4 | |
| SCHEMBL220827 | 0.81 | NOS1 (0.63) | NOS1NOS3NOS2PTPN1 | |
| SCHEMBL218644 | 0.81 | NOS1 (0.55) | NOS1NOS3NOS2 | |
| SCHEMBL4282766 | 0.81 | NOS1 (0.53) | NOS1NOS3NOS2KDM4E |
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-1910362-A1 | IMIDAZOPYRIDINE DERIVATIVES AS SIRTUIN MODULATING AGENTS | Sirtris Pharmaceuticals, Inc. (US) | 2008-04-16 | — | — | EP | disclosed |
| EP-1910385-A1 | BENZOTHIAZOLES AND THIAZOLOPYRIDINES AS SIRTUIN MODULATORS | Sirtris Pharmaceuticals, Inc. (US) | 2008-04-16 | — | — | EP | disclosed |
| WO-2007019346-A1 | BENZOTHIAZOLES AND THIAZOLOPYRIDINES AS SIRTUIN MODULATORS | SIRTRIS PHARMACEUTICALS, INC. (US) | 2007-02-15 | — | — | WO | disclosed |
| WO-2007019345-A1 | IMIDAZOPYRIDINE DERIVATIVES AS SIRTUIN MODULATING AGENTS | SIRTRIS PHARMACEUTICALS, INC. (US) | 2007-02-15 | — | — | WO | disclosed |