Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | IL6 | P05231 | 1/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11827111 | 0.82 | NPC1 (0.40) | NPC1RAB9ASMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL11824162 | 0.81 | MAPT (0.52) | NPC1RAB9ACYP1A2PTGS1PTGS2 | |
| SCHEMBL11821391 | 0.78 | ALDH1A1 (0.52) | RAB9ASMN1; SMN2CYP1A2CYP2D6ALDH1A1 | |
| SCHEMBL11823559 | 0.77 | MAPT (0.50) | NPC1RAB9ASMN1; SMN2ALDH1A1KMT2A | |
| SCHEMBL11819244 | 0.74 | JUN (0.41) | RAB9AALDH1A1NFKB1NFKB2RELA | |
| SCHEMBL23338555 | 0.74 | TDP1 (0.48) | RAB9AALDH1A1MAPTLMNA | |
| SCHEMBL22819595 | 0.74 | RAB9A (0.46) | NPC1RAB9ASMN1; SMN2ALDH1A1PTGS1 | |
| SCHEMBL11826476 | 0.74 | MAPT (0.35) | NPC1RAB9ASMN1; SMN2ALDH1A1PTGS1 | |
| SCHEMBL29922937 | 0.72 | SYK (0.46) | RAB9ASMN1; SMN2ALDH1A1KMT2AMAPT | |
| SCHEMBL28359009 | 0.72 | SYK (0.46) | RAB9ASMN1; SMN2ALDH1A1KMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-3978057-A | HYPOTENSIVE AGENTS | SANDOZ, INC. (US) | 1976-08-31 | — | — | US | disclosed |