Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIPC | P11150 | 1/20 | 0.40 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 4/20 | 0.36 |
| ▸ | CNR1 | P21554 | 3/20 | 0.36 |
| ▸ | DRD2 | P14416 | 5/20 | 0.34 |
| ▸ | DRD3 | P35462 | 5/20 | 0.34 |
| ▸ | DRD4 | P21917 | 3/20 | 0.34 |
| ▸ | HTR1D | P28221 | 2/20 | 0.34 |
| ▸ | DRD1 | P21728 | 2/20 | 0.34 |
| ▸ | DRD5 | P21918 | 2/20 | 0.34 |
| ▸ | HTR5A | P47898 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 2/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18374895 | 0.69 | DRD2 (0.35) | DRD2DRD3DRD4HTR1DDRD1 | |
| SCHEMBL17340574 | 0.67 | DRD2 (0.35) | DRD2DRD3DRD4HTR1DDRD1 | |
| SCHEMBL13726636 | 0.65 | GRM2 (0.51) | DRD2DRD3DRD4DRD1DRD5 | |
| SCHEMBL18364503 | 0.63 | DRD2 (0.33) | DRD2DRD3DRD4HTR1DDRD1 | |
| SCHEMBL25027141 | 0.62 | DRD2 (0.38) | LIPCLIPGDRD2DRD3DRD4 | |
| SCHEMBL15586261 | 0.61 | DRD2 (0.43) | DRD2DRD3DRD4HTR1DDRD1 | |
| SCHEMBL19948194 | 0.61 | DRD2 (0.41) | DRD2DRD3DRD4HTR1DDRD1 | |
| SCHEMBL3997164 | 0.60 | ALDH1A1 (0.65) | BRD4PTGER4 | |
| SCHEMBL16006621 | 0.60 | DRD2 (0.44) | DRD2DRD3DRD4HTR1DDRD1 | |
| SCHEMBL3997818 | 0.59 | ALDH1A1 (0.53) | LIPCLIPGCNR2CNR1BRD4 |
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-2012151139-A1 | ALKYNE BENZOTRIAZOLE DERIVATIVES | MERCK SHARP & DOHME CORP. (US) | 2012-11-08 | — | — | WO | disclosed |