Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRCP | P42785 | 4/20 | 0.56 |
| ▸ | DRD4 | P21917 | 11/20 | 0.50 |
| ▸ | DRD2 | P14416 | 9/20 | 0.50 |
| ▸ | DRD3 | P35462 | 8/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | NOS3 | P29474 | 1/20 | 0.45 |
| ▸ | NOS1 | P29475 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL12185982 | 0.90 | PRCP (0.68) | PRCPDRD4DRD2DRD3CYP1A2 | |
| SCHEMBL12185575 | 0.89 | PRCP (0.50) | PRCPDRD4DRD2DRD3SIGMAR1 | |
| SCHEMBL14686445 | 0.86 | PRCP (0.54) | PRCPDRD4DRD2DRD3SIGMAR1 | |
| SCHEMBL12186005 | 0.83 | PRCP (0.74) | PRCPDRD4DRD2DRD3ACHE | |
| SCHEMBL14686654 | 0.81 | DRD2 (0.52) | PRCPDRD4DRD2DRD3SIGMAR1 | |
| SCHEMBL12185578 | 0.80 | HTR2A (0.48) | PRCPDRD4DRD2DRD3 | |
| SCHEMBL14687101 | 0.80 | PRCP (0.67) | PRCPDRD4DRD2DRD3ACHE | |
| SCHEMBL12185551 | 0.78 | PRCP (0.73) | PRCPDRD4DRD2DRD3SIGMAR1 | |
| SCHEMBL12185527 | 0.76 | PRCP (0.70) | PRCPDRD4DRD2DRD3CYP1A2 | |
| SCHEMBL12186013 | 0.76 | PRCP (0.75) | PRCPDRD4DRD2DRD3CYP1A2 |
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-2011143057-A1 | NOVEL PROLYLCARBOXYPEPTIDASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-11-17 | — | — | WO | disclosed |