Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 9/20 | 0.46 |
| ▸ | CNR2 | P34972 | 6/20 | 0.46 |
| ▸ | CRHR1 | P34998 | 6/20 | 0.45 |
| ▸ | GSK3A | P49840 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4807155 | 0.83 | CNR1 (0.46) | CNR1CNR2CRHR1GSK3AGSK3B | |
| SCHEMBL30941215 | 0.83 | CNR1 (0.46) | CNR1CNR2CRHR1GSK3AGSK3B | |
| SCHEMBL4803537 | 0.83 | KDM4E (0.43) | CNR1CNR2CRHR1KDM4EDPP4 | |
| SCHEMBL4810291 | 0.82 | KDM4E (0.42) | CNR1CNR2KDM4EDPP4 | |
| SCHEMBL4802465 | 0.82 | CNR1 (0.39) | CNR1CNR2CRHR1KDM4EDPP4 | |
| SCHEMBL4804829 | 0.80 | CNR1 (0.60) | CNR1CNR2 | |
| SCHEMBL4804699 | 0.78 | CNR1 (0.42) | CNR1CNR2CRHR1GSK3AGSK3B | |
| SCHEMBL4807031 | 0.75 | CNR1 (0.53) | CNR1CNR2CRHR1GSK3AGSK3B | |
| SCHEMBL4808021 | 0.74 | CNR1 (0.43) | CNR1CNR2CRHR1GSK3AGSK3B | |
| SCHEMBL4807595 | 0.74 | CNR1 (0.55) | CNR1CNR2DPP4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7405221-B2 | Substituted pyrimidines | MERCK & CO., INC. (US) | 2008-07-29 | — | — | US | disclosed |
| US-7405221-B2 | Substituted pyrimidines | MERCK & CO., INC. (US) | 2008-07-29 | — | — | US | disclosed |
| US-7405221-B2 | Substituted pyrimidines | MERCK & CO., INC. (US) | 2008-07-29 | — | — | US | disclosed |
| EP-1546115-A2 | SUBSTITUTED PYRIMIDINES | Merck & Co., Inc. (US) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004029204-A2 | SUBSTITUTED PYRIMIDINES | MERCK & CO., INC. (US) | 2004-04-08 | — | — | WO | disclosed |