Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 13/20 | 0.40 |
| ▸ | CTSD | P07339 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | CTSB | P07858 | 9/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL5122094 | 1.00 | BACE1 (0.40) | BACE1CTSDALDH1A1HTTTSHR | |
| SCHEMBL5579937 | 0.91 | CTNNB1 (0.41) | BACE1CTSDALDH1A1HTTMAPT | |
| SCHEMBL5579933 | 0.91 | CTNNB1 (0.41) | BACE1CTSDALDH1A1HTTMAPT | |
| SCHEMBL5579479 | 0.88 | CTNNB1 (0.44) | BACE1CTSDALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL5123918 | 0.84 | ALDH1A1 (0.39) | BACE1CTSDALDH1A1HTTTSHR | |
| SCHEMBL5579884 | 0.83 | CTNNB1 (0.44) | BACE1CTSDCTSB | |
| SCHEMBL5579887 | 0.83 | CTNNB1 (0.44) | BACE1CTSDCTSB | |
| SCHEMBL5130119 | 0.83 | BACE1 (0.43) | BACE1CTSDCTSB | |
| SCHEMBL5130126 | 0.83 | BACE1 (0.43) | BACE1CTSDCTSB | |
| SCHEMBL5124839 | 0.81 | BACE1 (0.45) | BACE1CTSDCTSB |
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-7294642-B2 | 1,3-Diamino-2-hydroxypropane pro-drug derivatives | ELAN PHARMACEUTICALS, INC. (US) | 2007-11-13 | — | — | US | claimed |