Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | GGT1 | P19440 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | ARG1 | P05089 | 1/20 | 0.32 |
| ▸ | ARG2 | P78540 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.32 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.32 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28842189 | 0.98 | ALDH1A1 (0.34) | ALDH1A1GGT1MEN1CYP1A2THRB | |
| Hydrochloric Acid SCHEMBL29880532 | 0.98 | ALDH1A1 (0.34) | ALDH1A1GGT1MEN1CYP1A2THRB | |
| SCHEMBL27665693 | 0.87 | CHRM1 (0.38) | ALDH1A1GGT1MEN1CYP1A2THRB | |
| SCHEMBL27665332 | 0.83 | CA2 (0.48) | CA2MAPK1CA1SLC1A3SLC1A2 | |
| SCHEMBL29489674 | 0.78 | ALDH1A1 (0.34) | ALDH1A1GGT1MEN1CYP1A2THRB | |
| SCHEMBL22636108 | 0.78 | ALDH1A1 (0.34) | ALDH1A1GGT1MEN1CYP1A2THRB | |
| SCHEMBL5051493 | 0.78 | TSHR (0.46) | ALDH1A1GGT1MEN1CYP1A2THRB | |
| SCHEMBL20854287 | 0.78 | ALDH1A1 (0.34) | ALDH1A1GGT1MEN1CYP1A2THRB | |
| SCHEMBL202556 | 0.78 | ALDH1A1 (0.34) | ALDH1A1GGT1MEN1CYP1A2THRB | |
| SCHEMBL162434 | 0.78 | ALDH1A1 (0.34) | ALDH1A1GGT1MEN1CYP1A2THRB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1886363-A | Amino acids with affinity for the alpha2delta-protein | WARNER LAMBERT CO (US) | 2006-12-27 | — | — | CN | claimed |
| CN-1886363-A | Amino acids with affinity for the alpha2delta-protein | WARNER LAMBERT CO (US) | 2006-12-27 | — | — | CN | disclosed |