Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
| ▸ | CDC7 | O00311 | 1/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.37 |
| ▸ | TACR1 | P25103 | 2/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL4637826 | 0.94 | ALDH1A1 (0.47) | ALDH1A1GAACYP19A1TSHRPOLB | |
| SCHEMBL4637775 | 0.89 | POLB (0.45) | ALDH1A1GAACYP19A1TSHRPOLB | |
| SCHEMBL4637824 | 0.87 | ALDH1A1 (0.44) | ALDH1A1GAACYP19A1TSHRPOLB | |
| SCHEMBL4638053 | 0.84 | ALDH1A1 (0.44) | ALDH1A1GAACYP19A1TSHRPOLB | |
| SCHEMBL4638563 | 0.83 | ALDH1A1 (0.47) | ALDH1A1GAACYP19A1TSHRPOLB | |
| SCHEMBL4638478 | 0.83 | ADORA3 (0.41) | ALDH1A1GAACYP19A1TSHRPOLB | |
| SCHEMBL6072058 | 0.82 | ALDH1A1 (0.53) | ALDH1A1GAACYP19A1TSHRPOLB | |
| SCHEMBL4638473 | 0.81 | ALDH1A1 (0.65) | ALDH1A1GAACYP19A1TSHRPOLB | |
| SCHEMBL4706776 | 0.81 | ALDH1A1 (0.54) | ALDH1A1GAACYP19A1TSHRPOLB | |
| SCHEMBL4637803 | 0.80 | CDC7 (0.37) | ALDH1A1GAACYP19A1TSHRPOLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501808-B1 | TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-07-02 | — | — | EP | disclosed |