Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.42 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.40 |
| ▸ | PRNP | P04156 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | FABP4 | P15090 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | CDC25B | P30305 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10447306 | 0.84 | CYP1A2 (0.33) | ALDH1A1ALOX15TAS2R14KDM4ECA12 | |
| SCHEMBL12760731 | 0.82 | ALDH1A1 (0.44) | ALDH1A1ALOX15NR4A1NR4A2NR4A3 | |
| SCHEMBL29403670 | 0.82 | AKR1C3 (0.47) | ALDH1A1NR4A1AKR1C3CDC25BMAPT | |
| SCHEMBL30259301 | 0.79 | ALDH1A1 (0.56) | ALDH1A1ALOX15NR4A1NR4A2NR4A3 | |
| SCHEMBL31100 | 0.79 | ALDH1A1 (0.56) | ALDH1A1ALOX15NR4A1NR4A2NR4A3 | |
| SCHEMBL6828127 | 0.79 | LMNA (0.44) | ALDH1A1ALOX15TSHRKDM4ECA12 | |
| SCHEMBL1116170 | 0.79 | ALDH1A1 (0.60) | ALDH1A1ALOX15NR4A1NR4A2NR4A3 | |
| SCHEMBL674718 | 0.78 | ALDH1A1 (0.44) | ALDH1A1ALOX15NR4A1NR4A2NR4A3 | |
| SCHEMBL1815797 | 0.78 | ALDH1A1 (0.52) | ALDH1A1ALOX15NR4A1NR4A2NR4A3 | |
| SCHEMBL997602 | 0.78 | ALDH1A1 (0.44) | ALDH1A1ALOX15NR4A1NR4A2NR4A3 |
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-2004073612-A2 | ESTROGEN RECEPTOR MODULATORS | MERCK & CO. INC. (US) | 2004-09-02 | — | — | WO | disclosed |