Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.61 |
| ▸ | TP53 | P04637 | 3/20 | 0.61 |
| ▸ | MAPT | P10636 | 3/20 | 0.61 |
| ▸ | NPC1 | O15118 | 3/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | MAOA | P21397 | 1/20 | 0.61 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.61 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 3/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.52 |
| ▸ | MEN1 | O00255 | 4/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HTR2B | P41595 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14939328 | 0.82 | RAB9A (0.71) | RAB9ATP53MAPTNPC1SMN1; SMN2 | |
| SCHEMBL8958196 | 0.79 | RAB9A (0.67) | RAB9ATP53MAPTNPC1SMN1; SMN2 | |
| Anisindione SCHEMBL49379 | 0.76 | RAB9A (1.00) | RAB9ATP53MAPTNPC1SMN1; SMN2 | |
| Anisindione SCHEMBL29688105 | 0.76 | RAB9A (1.00) | RAB9ATP53MAPTNPC1SMN1; SMN2 | |
| SCHEMBL14939354 | 0.76 | RAB9A (0.63) | RAB9ATP53MAPTNPC1SMN1; SMN2 | |
| SCHEMBL14939144 | 0.76 | RAB9A (0.53) | RAB9ATP53MAPTNPC1SMN1; SMN2 | |
| SCHEMBL14939218 | 0.75 | RAB9A (0.61) | RAB9ATP53MAPTNPC1SMN1; SMN2 | |
| SCHEMBL14939515 | 0.72 | RAB9A (0.49) | RAB9ATP53MAPTNPC1SMN1; SMN2 | |
| SCHEMBL855370 | 0.70 | RAB9A (1.00) | RAB9ATP53MAPTNPC1SMN1; SMN2 | |
| SCHEMBL14940174 | 0.69 | MAPT (0.63) | RAB9ATP53MAPTNPC1SMN1; 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-2013068785-A1 | INDANONE AND INDANDIONE DERIVATIVES AND HETEROCYCLIC ANALOGS | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |