Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | AR | P10275 | 2/20 | 0.36 |
| ▸ | S100B | P04271 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7089720 | 0.98 | ALDH1A1 (0.42) | ALDH1A1CYP3A4PSMD14TSHRMAPK1 | |
| SCHEMBL27774100 | 0.84 | ALDH1A1 (0.60) | ALDH1A1CYP3A4PSMD14TSHRMAPK1 | |
| SCHEMBL6572332 | 0.83 | TDP1 (0.36) | ALDH1A1CYP3A4PSMD14TSHRMAPK1 | |
| SCHEMBL27461663 | 0.82 | CYP3A4 (0.55) | ALDH1A1CYP3A4PSMD14TSHRMAPK1 | |
| SCHEMBL143242 | 0.80 | CYP3A4 (0.61) | ALDH1A1CYP3A4PSMD14TSHRMAPK1 | |
| Hydrochloric Acid SCHEMBL5697631 | 0.78 | CYP3A4 (0.59) | ALDH1A1CYP3A4PSMD14TSHRMAPK1 | |
| Hydrochloric Acid SCHEMBL6657541 | 0.78 | CYP3A4 (0.59) | ALDH1A1CYP3A4PSMD14TSHRMAPK1 | |
| SCHEMBL2790604 | 0.77 | ALDH1A1 (0.53) | ALDH1A1CYP3A4PSMD14TSHRMAPK1 | |
| SCHEMBL28944716 | 0.77 | ALDH1A1 (0.38) | ALDH1A1CYP3A4PSMD14TSHRMAPK1 | |
| SCHEMBL13949611 | 0.77 | CYP3A4 (0.57) | ALDH1A1CYP3A4PSMD14TSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1813034-A | Optical recording materials having high storage density | CIBA SC HOLDING AG (CH) | 2006-08-02 | — | — | CN | disclosed |