Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1552610 | 0.87 | ALDH1A1 (0.54) | ALDH1A1TDP1TSHRCYP3A4 | |
| SCHEMBL8064966 | 0.78 | ALDH1A1 (0.45) | ALDH1A1TDP1TSHRCYP3A4 | |
| SCHEMBL31452870 | 0.74 | ALDH1A1 (0.41) | ALDH1A1TDP1TSHRCYP3A4 | |
| SCHEMBL18000467 | 0.74 | ALDH1A1 (0.41) | ALDH1A1TDP1TSHRPOLB | |
| SCHEMBL712674 | 0.64 | ALDH1A1 (0.42) | ALDH1A1TDP1TSHRCYP3A4TRPM8 | |
| SCHEMBL29386003 | 0.64 | ALDH1A1 (0.42) | ALDH1A1TDP1TSHRCYP3A4TRPM8 | |
| SCHEMBL9732800 | 0.63 | ALDH1A1 (0.50) | ALDH1A1TDP1TSHRTRPM8KDM4E | |
| SCHEMBL10153228 | 0.62 | ALDH1A1 (0.33) | ALDH1A1TDP1TSHRCYP3A4 | |
| SCHEMBL2113357 | 0.62 | ALDH1A1 (0.39) | ALDH1A1TDP1TSHRKDM4EL3MBTL1 | |
| SCHEMBL191847 | 0.62 | ALDH1A1 (0.39) | ALDH1A1TDP1TSHRCYP3A4KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| US-6245913-B1 | OXIDATION OF LUTIDINE; EASIER PURIFICATION | WOCKHARDT EUROPE LIMITED (IE) | 2001-06-12 | — | — | US | disclosed |