Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.51 |
| ▸ | SELP | P16109 | 1/20 | 0.47 |
| ▸ | FAAH | O00519 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | NR5A2 | O00482 | 1/20 | 0.45 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.45 |
| ▸ | FABP3 | P05413 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Phosphocholine SCHEMBL5087547 | 0.99 | ALDH1A1 (0.56) | ALDH1A1S1PR1SELPFAAHMAPT | |
| Phosphocholine SCHEMBL1557025 | 0.91 | SMN1; SMN2 (0.53) | ALDH1A1MAPTSMN1; SMN2NR5A2NR5A1 | |
| Phosphocholine SCHEMBL3713381 | 0.89 | S1PR1 (0.53) | ALDH1A1S1PR1SELPSMN1; SMN2NR5A2 | |
| SCHEMBL538239 | 0.87 | FABP3 (0.52) | ALDH1A1S1PR1SELPSMN1; SMN2FABP3 | |
| SCHEMBL6027169 | 0.86 | ALDH1A1 (0.69) | ALDH1A1S1PR1MAPTSMN1; SMN2NR5A2 | |
| SCHEMBL1576782 | 0.85 | ALDH1A1 (0.66) | ALDH1A1S1PR1SELPFAAHMAPT | |
| SCHEMBL2561609 | 0.85 | ALDH1A1 (0.66) | ALDH1A1S1PR1SELPFAAHMAPT | |
| SCHEMBL4619726 | 0.84 | ALDH1A1 (0.64) | ALDH1A1S1PR1SELPFAAHMAPT | |
| SCHEMBL479563 | 0.84 | ALDH1A1 (0.64) | ALDH1A1S1PR1SELPFAAHMAPT | |
| SCHEMBL479610 | 0.84 | ALDH1A1 (0.64) | ALDH1A1S1PR1SELPFAAHMAPT |
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-2004091520-A2 | METHODS AND COMPOSITIONS FOR TREATING ATHEROSCLEROSIS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2004-10-28 | — | — | WO | disclosed |