Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 6/20 | 0.41 |
| ▸ | BRD4 | O60885 | 6/20 | 0.39 |
| ▸ | PTGES | O14684 | 2/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3960529 | 0.87 | PARP1 (0.42) | PARP1BRD4PTGESHCRTR1HCRTR2 | |
| SCHEMBL4071073 | 0.82 | PTGES (0.43) | BRD4PTGESHCRTR1HCRTR2 | |
| SCHEMBL3962137 | 0.80 | DHODH (0.43) | PARP1 | |
| SCHEMBL13907910 | 0.80 | BRD4 (0.41) | PARP1BRD4PTGESHCRTR1HCRTR2 | |
| SCHEMBL13908149 | 0.77 | BRD4 (0.41) | PARP1BRD4PTGES | |
| SCHEMBL1285574 | 0.76 | BRD4 (0.45) | PARP1BRD4PTGES | |
| SCHEMBL9413571 | 0.76 | PRKCZ (0.40) | PTGES | |
| SCHEMBL13907882 | 0.75 | NPC1 (0.49) | BRD4HCRTR1HCRTR2 | |
| SCHEMBL1118704 | 0.74 | ACACB (0.39) | PARP1PTGES | |
| SCHEMBL1285887 | 0.73 | PTGES (0.36) | PARP1BRD4PTGESHCRTR1HCRTR2 |
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-2079736-A1 | SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS | Rigel Pharmaceuticals, Inc. (US) | 2009-07-22 | — | — | EP | disclosed |
| WO-2009034028-A2 | NOVEL COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-03-19 | — | — | WO | disclosed |
| WO-2009034029-A2 | 1-SUBSTITUTED 4-HETEROCYCLYLPIPERIDINES FOR USE AS CGRP ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-03-19 | — | — | WO | disclosed |
| WO-2008083356-A1 | SUBSTITUTED TRIAZOLES USEFUL AS AXL INHIBITORS | RIGEL PHARMACEUTICALS, INC. (US) | 2008-07-10 | — | — | WO | disclosed |