Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCGR | P47871 | 20/20 | 0.68 |
| ▸ | GIPR | P48546 | 10/20 | 0.68 |
| ▸ | VIPR2 | P41587 | 4/20 | 0.59 |
| ▸ | GLP1R | P43220 | 2/20 | 0.59 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.53 |
| ▸ | VIPR1 | P32241 | 1/20 | 0.53 |
| ▸ | DUSP2 | Q05923 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL2643224 | 1.00 | GCGR (0.68) | GCGRGIPRVIPR2GLP1RKCNH2 | |
| SCHEMBL2657857 | 0.92 | GCGR (0.80) | GCGRGIPRVIPR2GLP1RKCNH2 | |
| SCHEMBL2644894 | 0.92 | GCGR (0.80) | GCGRGIPRVIPR2GLP1RKCNH2 | |
| SCHEMBL2643243 | 0.91 | GCGR (0.67) | GCGRGIPRVIPR2GLP1RKCNH2 | |
| SCHEMBL2643172 | 0.89 | GCGR (0.87) | GCGRGIPRVIPR2GLP1RKCNH2 | |
| SCHEMBL2643194 | 0.88 | GCGR (0.66) | GCGRGIPRVIPR2GLP1RKCNH2 | |
| SCHEMBL2657768 | 0.83 | GCGR (0.75) | GCGRGIPRVIPR2GLP1RKCNH2 | |
| SCHEMBL2645262 | 0.83 | GCGR (0.75) | GCGRGIPRVIPR2GLP1RKCNH2 | |
| SCHEMBL2643409 | 0.82 | GCGR (0.49) | GCGRGIPRVIPR2GLP1R | |
| SCHEMBL2643518 | 0.81 | GCGR (0.65) | GCGRGIPRVIPR2GLP1RKCNH2 |
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-1940799-A1 | PYRAZOLE DERIVATIVES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE | Merck & Co., Inc. (US) | 2008-07-09 | — | — | EP | disclosed |
| WO-2007047676-A1 | PYRAZOLE DERIVATIVES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE | MERCK & CO., INC. (US) | 2007-04-26 | — | — | WO | disclosed |