Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 14/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 14/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4749038 | 1.00 | PARP1 (0.43) | PARP1OPRM1OPRD1KDM1AMAOA | |
| SCHEMBL4813149 | 0.91 | KMO (0.42) | OPRD1KDM1AMAOAMAOB | |
| SCHEMBL4019710 | 0.88 | RORC (0.43) | KDM1A | |
| SCHEMBL4019712 | 0.88 | RORC (0.43) | KDM1A | |
| SCHEMBL4024572 | 0.88 | RORC (0.43) | KDM1A | |
| SCHEMBL4024492 | 0.88 | DRD2 (0.43) | — | |
| SCHEMBL4020120 | 0.88 | GRIN2B (0.40) | — | |
| SCHEMBL4024495 | 0.88 | DRD2 (0.43) | — | |
| SCHEMBL4020117 | 0.88 | GRIN2B (0.40) | — | |
| SCHEMBL4751416 | 0.87 | MEN1 (0.40) | OPRM1OPRD1OPRK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008140810-A1 | CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS | CYTOKINETICS, INCORPORATED (US) | 2008-11-20 | — | — | WO | disclosed |