Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.60 |
| ▸ | MAPT | P10636 | 6/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.60 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | SYK | P43405 | 2/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.57 |
| ▸ | HTT | P42858 | 3/20 | 0.57 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.53 |
| ▸ | RELA | Q04206 | 3/20 | 0.53 |
| ▸ | FOS | P01100 | 2/20 | 0.53 |
| ▸ | JUN | P05412 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 3/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL16274916 | 0.86 | RAB9A (0.53) | ALDH1A1MAPTSMN1; SMN2POLBMAPK1 | |
| SCHEMBL655816 | 0.84 | RAB9A (0.51) | ALDH1A1MAPTSMN1; SMN2POLBSYK | |
| SCHEMBL445955 | 0.84 | ALDH1A1 (0.65) | ALDH1A1MAPTSMN1; SMN2POLBTDP1 | |
| SCHEMBL6631327 | 0.83 | ALDH1A1 (0.58) | ALDH1A1MAPTSMN1; SMN2POLBTDP1 | |
| SCHEMBL22165397 | 0.83 | MAPT (0.75) | ALDH1A1MAPTSMN1; SMN2POLBTDP1 | |
| SCHEMBL15584081 | 0.82 | ALDH1A1 (0.63) | ALDH1A1MAPTSMN1; SMN2POLBTDP1 | |
| SCHEMBL1313596 | 0.82 | SYK (0.79) | ALDH1A1MAPTSMN1; SMN2POLBTDP1 | |
| SCHEMBL16274678 | 0.82 | NFKB1 (0.57) | ALDH1A1MAPTSMN1; SMN2POLBMAPK1 | |
| SCHEMBL6632274 | 0.80 | ALDH1A1 (0.60) | ALDH1A1MAPTSMN1; SMN2POLBTDP1 | |
| SCHEMBL16274738 | 0.80 | AGTR1 (0.48) | ALDH1A1MAPTSMN1; SMN2POLBMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2810944-A1 | HETEROCYCLIC COMPOUND HAVING ANTI-HIV ACTIVITY | Toyama Chemical Co., Ltd. (JP) | 2014-12-10 | — | — | EP | disclosed |