Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 5/20 | 0.55 |
| ▸ | ACHE | P22303 | 2/20 | 0.53 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.40 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14327883 | 0.80 | NPC1 (0.69) | S1PR1S1PR3LMNANPC1RAB9A | |
| SCHEMBL8360132 | 0.79 | ACHE (0.63) | S1PR1ACHELMNATHRBNPC1 | |
| SCHEMBL13415305 | 0.78 | ACHE (0.80) | ACHELMNATHRBNPC1RAB9A | |
| SCHEMBL5256464 | 0.76 | CHRNB2 (0.69) | S1PR1ACHENPC1RAB9ATP53 | |
| SCHEMBL12490255 | 0.74 | ACHE (0.58) | ACHELMNATHRBNPC1RAB9A | |
| SCHEMBL21408769 | 0.74 | S1PR1 (0.41) | S1PR1S1PR3ALOX5AP | |
| SCHEMBL11791860 | 0.73 | POLB (0.53) | S1PR1S1PR3LMNANPC1RAB9A | |
| SCHEMBL806849 | 0.72 | ACHE (0.66) | S1PR1ACHELMNATHRBNPC1 | |
| SCHEMBL5952948 | 0.72 | ACHE (0.71) | ACHELMNATHRBNPC1RAB9A | |
| SCHEMBL13416336 | 0.72 | S1PR1 (1.00) | S1PR1S1PR3NPC1RAB9AMAPT |
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-2004002491-A1 | MORPHOLINE AND TETRAHYDROPYRAN DRIVATIVES AND THEIR USE AS CATHEPSIN INHIBITORS | AVENTIS PHARMACEUTICALS INC. (US) | 2004-01-08 | — | — | WO | disclosed |