Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1758687 | 0.87 | CNR2 (0.63) | CNR2SMN1; SMN2GAAHTTNPSR1 | |
| SCHEMBL6879293 | 0.78 | GAA (0.49) | CNR2SMN1; SMN2GAAHTTNPSR1 | |
| SCHEMBL6879978 | 0.72 | CNR2 (0.45) | CNR2SMN1; SMN2GAAHTTALDH1A1 | |
| SCHEMBL10465534 | 0.71 | SMN1; SMN2 (0.60) | SMN1; SMN2HTTCYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL10465715 | 0.69 | CYP1A2 (0.54) | SMN1; SMN2GAANPSR1CYP1A2CYP2C19 | |
| SCHEMBL14417570 | 0.69 | NR3C1 (0.68) | SMN1; SMN2GAACYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL16078326 | 0.69 | CYP1A2 (0.55) | CNR2SMN1; SMN2GAAHTTCYP1A2 | |
| SCHEMBL19481652 | 0.69 | CYP1A2 (0.52) | SMN1; SMN2GAAHTTNPSR1CYP1A2 | |
| SCHEMBL10549081 | 0.68 | CYP1A2 (0.60) | SMN1; SMN2GAACYP1A2CYP2C19ALDH1A1 | |
| SCHEMBL14398955 | 0.68 | ALDH1A1 (0.40) | NPSR1CYP2C19ALDH1A1 |
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-2011058582-A1 | HISTONE DEACETYLASE INHIBITORS FOR THE TREATMENT OF FUNGAL INFECTIONS | ORCHID RESEARCH LABORATORIES LTD. (IN) | 2011-05-19 | — | — | WO | disclosed |