Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 4/20 | 0.44 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.44 |
| ▸ | NPEPPS | P55786 | 1/20 | 0.44 |
| ▸ | RORC | P51449 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | TACR1 | P25103 | 2/20 | 0.41 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.40 |
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL7220711 | 1.00 | PDE4B (0.44) | PDE4BGPR119NPEPPSRORCNOS2 | |
| SCHEMBL7220714 | 1.00 | PDE4B (0.44) | PDE4BGPR119NPEPPSRORCNOS2 | |
| SCHEMBL7214770 | 0.85 | GPR119 (0.48) | PDE4BGPR119RORCTACR1USP30 | |
| SCHEMBL7214766 | 0.85 | GPR119 (0.48) | PDE4BGPR119RORCTACR1USP30 | |
| SCHEMBL7214765 | 0.85 | GPR119 (0.48) | PDE4BGPR119RORCTACR1USP30 | |
| SCHEMBL5821047 | 0.83 | TACR1 (0.56) | PDE4BRORCTACR1NAMPTPDE4A | |
| SCHEMBL7213834 | 0.80 | GPR119 (0.49) | PDE4BGPR119RORCUSP30NAMPT | |
| SCHEMBL7213823 | 0.80 | GPR119 (0.49) | PDE4BGPR119RORCUSP30NAMPT | |
| SCHEMBL7213829 | 0.80 | GPR119 (0.49) | PDE4BGPR119RORCUSP30NAMPT | |
| SCHEMBL31449892 | 0.80 | PDE4B (0.45) | PDE4BRORCTACR1KDM4ENAMPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6610692-B1 | Anticoagulants | MERCK & CO., INC. | 2003-08-26 | — | — | US | disclosed |
| EP-1124822-A4 | THROMBIN INHIBITORS | MERCK & CO INC (US) | 2002-04-03 | — | — | EP | disclosed |
| EP-1124822-A1 | THROMBIN INHIBITORS | Merck & Co., Inc. (US) | 2001-08-22 | — | — | EP | disclosed |
| WO-2000026211-A1 | THROMBIN INHIBITORS | MERCK & CO., INC. (US) | 2000-05-11 | — | — | WO | disclosed |