Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.68 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.67 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.67 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.67 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.67 |
| ▸ | TP53 | P04637 | 5/20 | 0.67 |
| ▸ | MAPT | P10636 | 5/20 | 0.67 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.66 |
| ▸ | GABRP | O00591 | 1/20 | 0.62 |
| ▸ | GABRD | O14764 | 1/20 | 0.62 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.62 |
| ▸ | ALB | P02768 | 1/20 | 0.62 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.62 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.62 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.62 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.62 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.62 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL7069966 | 0.89 | TP53 (0.64) | NPSR1ALDH1A1SMN1; SMN2OPRK1NR1I2 | |
| SCHEMBL16777701 | 0.88 | NPSR1 (0.72) | NPSR1ALDH1A1SMN1; SMN2OPRK1NR1I2 | |
| SCHEMBL9039066 | 0.88 | CYP1A2 (0.75) | NPSR1ALDH1A1SMN1; SMN2OPRK1NR1I2 | |
| SCHEMBL9038774 | 0.87 | NPSR1 (0.65) | NPSR1ALDH1A1SMN1; SMN2OPRK1NR1I2 | |
| SCHEMBL6940855 | 0.87 | SMN1; SMN2 (0.64) | NPSR1ALDH1A1SMN1; SMN2TP53MAPT | |
| SCHEMBL11806947 | 0.85 | MAPT (0.72) | NPSR1ALDH1A1SMN1; SMN2OPRK1NR1I2 | |
| SCHEMBL5352101 | 0.84 | NPSR1 (0.69) | NPSR1ALDH1A1SMN1; SMN2OPRK1NR1I2 | |
| SCHEMBL5355886 | 0.83 | OPRK1 (0.73) | NPSR1ALDH1A1SMN1; SMN2OPRK1NR1I2 | |
| SCHEMBL5417682 | 0.82 | OPRK1 (0.65) | NPSR1ALDH1A1SMN1; SMN2OPRK1NR1I2 | |
| SCHEMBL26331020 | 0.82 | OPRK1 (0.68) | NPSR1ALDH1A1SMN1; SMN2OPRK1NR1I2 |
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-1342719-A1 | Benzodiazepine derivatives useful as CCK-Receptor Antagonists | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 2003-09-10 | — | — | EP | disclosed |