Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1LG2 | Q9BQ51 | 1/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.30 |
| ▸ | F12 | P00748 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6369721 | 0.76 | PDCD1LG2 (0.44) | PDCD1LG2CD274HTR7S1PR1DRD2 | |
| SCHEMBL6369616 | 0.71 | DPP4 (0.41) | ALDH1A1HTTGRIN2BTDP1 | |
| SCHEMBL25159795 | 0.67 | HTR7 (0.48) | PDCD1LG2CD274HTR7ALDH1A1DRD2 | |
| SCHEMBL13550112 | 0.66 | PNMT (0.41) | DRD2DRD3TDP1HRH3 | |
| SCHEMBL13940577 | 0.64 | DPP4 (0.41) | GRIN2BTDP1 | |
| SCHEMBL10081908 | 0.64 | RBP4 (0.44) | GRIN2B | |
| SCHEMBL13355034 | 0.64 | PSEN1 (0.37) | PDCD1LG2CD274DRD2DRD3TDP1 | |
| SCHEMBL14097919 | 0.61 | LMNA (0.43) | PDCD1LG2CD274ALDH1A1DRD2DRD3 | |
| SCHEMBL5535028 | 0.61 | CYP2C19 (0.46) | PDCD1LG2CD274S1PR1DRD2DRD3 | |
| SCHEMBL7774505 | 0.60 | OGA (0.40) | PDCD1LG2CD274HTR7S1PR1DRD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2268280-B1 | Quinolizidinone M1 receptor positive allosteric modulators | MERCK SHARP & DOHME (US) | 2013-04-24 | — | — | EP | disclosed |