Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2093293 | 0.85 | PDE10A (0.35) | ELANEHTTNPSR1KDM4ENPC1 | |
| SCHEMBL10686543 | 0.80 | CYP2A6 (0.35) | HTTNPSR1KDM4ENPC1ALOX12 | |
| SCHEMBL9775376 | 0.75 | TBXAS1 (0.32) | — | |
| SCHEMBL2094568 | 0.75 | TRPA1 (0.36) | HTTNPSR1KDM4ENPC1ALOX12 | |
| SCHEMBL10687422 | 0.74 | CYP2A6 (0.42) | ALDH1A1 | |
| SCHEMBL10689562 | 0.73 | MAPK8 (0.43) | HTTKDM4EGSK3BMEN1ALDH1A1 | |
| SCHEMBL8583983 | 0.73 | CYP1A2 (0.33) | — | |
| SCHEMBL10689332 | 0.73 | TBXAS1 (0.31) | — | |
| SCHEMBL31662555 | 0.72 | CYP2A6 (0.34) | ALDH1A1 | |
| SCHEMBL4979415 | 0.70 | ALDH1A1 (0.38) | HTTNPSR1KDM4ENPC1ALOX12 |
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 |
|---|---|---|---|---|---|---|---|
| US-4737516-A | FUNGICIDES | SANDOZ LTD. (CH) | 1988-04-12 | — | — | US | disclosed |