Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.74 |
| ▸ | TSHR | P16473 | 4/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 2/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | DGKA | P23743 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2702326 | 1.00 | ALDH1A1 (0.74) | ALDH1A1TSHRCYP3A4CES2THRB | |
| SCHEMBL22372 | 1.00 | ALDH1A1 (0.74) | ALDH1A1TSHRCYP3A4CES2THRB | |
| SCHEMBL275015 | 1.00 | ALDH1A1 (0.74) | ALDH1A1TSHRCYP3A4CES2THRB | |
| SCHEMBL8125550 | 1.00 | ALDH1A1 (0.74) | ALDH1A1TSHRCYP3A4CES2THRB | |
| SCHEMBL48354 | 1.00 | ALDH1A1 (0.74) | ALDH1A1TSHRCYP3A4CES2THRB | |
| SCHEMBL1947725 | 0.98 | ALDH1A1 (0.71) | ALDH1A1TSHRCYP3A4CES2THRB | |
| Acetic Acid Butyl Ester SCHEMBL10478840 | 0.98 | ALDH1A1 (0.78) | ALDH1A1TSHRCYP3A4CES2THRB | |
| SCHEMBL28961007 | 0.98 | ALDH1A1 (0.71) | ALDH1A1TSHRCYP3A4CES2THRB | |
| SCHEMBL1924009 | 0.98 | ALDH1A1 (0.71) | ALDH1A1TSHRCYP3A4CES2THRB | |
| Methane SCHEMBL4866700 | 0.98 | ALDH1A1 (0.71) | ALDH1A1TSHRCYP3A4CES2THRB |
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-20100003211-A1 | ANTIFOULING COATING COMPOSITION AND UNDERWATER STRUCTURE USING THE SAME | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2010-01-07 | — | — | US | disclosed |