Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | NPC1 | O15118 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL789561 | 0.81 | TRPC3 (0.42) | RAB9AALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL12503735 | 0.76 | TRPC3 (0.48) | RAB9AALDH1A1NPC1SMN1; SMN2MAPT | |
| SCHEMBL806645 | 0.66 | TRPC3 (0.58) | ALDH1A1SMN1; SMN2MAPTTP53 | |
| SCHEMBL17828172 | 0.63 | KCNH2 (0.47) | RAB9AALDH1A1NPC1SMN1; SMN2L3MBTL1 | |
| SCHEMBL8048110 | 0.62 | SMN1; SMN2 (0.51) | RAB9AALDH1A1NPC1SMN1; SMN2MAPT | |
| SCHEMBL8275450 | 0.61 | HRH3 (0.76) | ALDH1A1POLBLMNAL3MBTL1ACHE | |
| SCHEMBL12749634 | 0.61 | NPC1 (1.00) | RAB9AALDH1A1NPC1SMN1; SMN2MAPT | |
| SCHEMBL15214324 | 0.61 | TSHR (0.59) | RAB9AALDH1A1NPC1MAPTMAPK1 | |
| SCHEMBL27954331 | 0.60 | NPC1 (0.41) | RAB9AALDH1A1NPC1SMN1; SMN2MAPT | |
| SCHEMBL156415 | 0.60 | ACHE (0.67) | ALDH1A1MAPTKDM4EACHEMEN1 |
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-2012037351-A1 | COMPOUNDS | GLAXOSMITHKLINE LLC (US) | 2012-03-22 | — | — | WO | disclosed |