Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CYP17A1 | P05093 | 4/20 | 0.41 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 6/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 5/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | PDE5A | O76074 | 2/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | USP1 | O94782 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20937435 | 0.97 | MAPT (0.42) | TP53MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL20937381 | 0.93 | PDE5A (0.43) | TP53MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL20937432 | 0.92 | TP53 (0.44) | TP53MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL20937425 | 0.92 | MAPT (0.40) | TP53MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL20937403 | 0.92 | MAPT (0.42) | TP53MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL20937424 | 0.91 | CYP3A4 (0.40) | TP53MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL20937730 | 0.91 | MAPT (0.41) | TP53MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL20937380 | 0.90 | PDE5A (0.41) | TP53MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL24124556 | 0.90 | ADORA3 (0.37) | TP53MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL20937410 | 0.89 | CYP11B2 (0.38) | TP53MAPTNPC1RAB9ASMN1; SMN2 |
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-2019076844-A1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2019-04-25 | — | — | WO | disclosed |