Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.56 |
| ▸ | CCR4 | P51679 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.49 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | CNR2 | P34972 | 1/20 | 0.48 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2587055 | 0.90 | CYP1A2 (0.60) | NPSR1SPHK1CCR4CYP1A2OPRL1 | |
| SCHEMBL1972076 | 0.90 | CYP1A2 (0.60) | NPSR1SPHK1CCR4CYP1A2OPRL1 | |
| SCHEMBL1819248 | 0.90 | CYP1A2 (0.60) | NPSR1SPHK1CCR4CYP1A2OPRL1 | |
| SCHEMBL3055319 | 0.89 | SPHK1 (0.58) | NPSR1SPHK1CCR4MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL20790624 | 0.89 | CYP1A2 (0.59) | NPSR1SPHK1CCR4CYP1A2OPRL1 | |
| Hydrochloric Acid SCHEMBL992443 | 0.89 | CYP1A2 (0.59) | NPSR1SPHK1CCR4CYP1A2OPRL1 | |
| SCHEMBL2592830 | 0.89 | SPHK1 (0.58) | NPSR1SPHK1CCR4MEN1KMT2A | |
| SCHEMBL3399606 | 0.89 | SPHK1 (0.58) | NPSR1SPHK1CCR4MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL992441 | 0.89 | CYP1A2 (0.59) | NPSR1SPHK1CCR4CYP1A2OPRL1 | |
| SCHEMBL14598757 | 0.87 | NPSR1 (0.55) | NPSR1SPHK1CCR4MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-101965354-A | Novel 7-substituted 3-carboxyoxadiazino-quinolone derivatives, their preparation and their use as antibacterial agents | VETOQUINOL SA | 2011-02-02 | — | — | CN | disclosed |