Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | DRD4 | P21917 | 4/20 | 0.43 |
| ▸ | DRD2 | P14416 | 3/20 | 0.43 |
| ▸ | DRD3 | P35462 | 3/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | F7 | P08709 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.39 |
| ▸ | F3 | P13726 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 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 | |
|---|---|---|---|---|
| SCHEMBL8426990 | 1.00 | KDM4E (0.51) | KDM4ESMN1; SMN2DRD4DRD2DRD3 | |
| SCHEMBL8426892 | 0.90 | KDM4E (0.49) | KDM4ESMN1; SMN2DRD4DRD2DRD3 | |
| SCHEMBL8426887 | 0.90 | KDM4E (0.49) | KDM4ESMN1; SMN2DRD4DRD2DRD3 | |
| SCHEMBL8426843 | 0.84 | KDM4E (0.49) | KDM4ESMN1; SMN2DRD4DRD2DRD3 | |
| SCHEMBL8426847 | 0.84 | KDM4E (0.49) | KDM4ESMN1; SMN2DRD4DRD2DRD3 | |
| SCHEMBL8426855 | 0.83 | KDM4E (0.70) | KDM4ESMN1; SMN2DRD4DRD2DRD3 | |
| SCHEMBL8426856 | 0.83 | KDM4E (0.70) | KDM4ESMN1; SMN2DRD4DRD2DRD3 | |
| SCHEMBL8426806 | 0.78 | KDM4E (0.55) | KDM4ESMN1; SMN2DRD4DRD2DRD3 | |
| SCHEMBL8426807 | 0.78 | KDM4E (0.55) | KDM4ESMN1; SMN2DRD4DRD2DRD3 | |
| SCHEMBL5753567 | 0.78 | DRD4 (0.54) | DRD4DRD2DRD3ABCB1OPRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5861407-A | Tetrahydropyridine derivatives as dopamine receptor subtype ligands | MERCK SHARP & DOHME, LTD. (GB) | 1999-01-19 | — | — | US | disclosed |