Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CNR1 | P21554 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 5/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.47 |
| ▸ | NOX1 | Q9Y5S8 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL13969412 | 0.78 | EPHX2 (0.53) | CNR1NPC1MEN1KMT2ARAB9A | |
| SCHEMBL4118595 | 0.78 | IDH1 (0.58) | NPC1MEN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL11195209 | 0.77 | MEN1 (0.72) | ALDH1A1CNR1NPC1MEN1KMT2A | |
| SCHEMBL14680572 | 0.77 | RAB9A (0.67) | ALDH1A1NPC1MEN1KMT2ARAB9A | |
| SCHEMBL14550419 | 0.76 | EPHX1 (0.58) | NPC1MEN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL15975496 | 0.76 | EPHX1 (0.79) | NPC1MEN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL13945726 | 0.75 | EPHX1 (0.53) | NPC1MEN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL6014615 | 0.75 | RAB9A (0.61) | NPC1MEN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL4112577 | 0.75 | MAPT (0.64) | ALDH1A1NPC1MEN1KMT2ARAB9A | |
| SCHEMBL16942616 | 0.74 | IDH1 (0.57) | NPC1MEN1KMT2ARAB9ASMN1; 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-2011076678-A1 | SUBSTITUTED BENZAMIDE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-06-30 | — | — | WO | disclosed |