Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.36 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.36 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL8281052 | 0.92 | ALDH1A1 (0.40) | ALDH1A1TSHRMAPK1MAPTPOLB | |
| SCHEMBL8281048 | 0.90 | ALDH1A1 (0.53) | ALDH1A1TSHRMAPK1MAPTGAA | |
| SCHEMBL8281043 | 0.89 | ALDH1A1 (0.38) | ALDH1A1TSHRMAPK1MAPTGAA | |
| SCHEMBL26429167 | 0.81 | POLB (0.51) | ALDH1A1TSHRMAPK1MAPTGAA | |
| SCHEMBL28909976 | 0.80 | ALDH1A1 (0.41) | ALDH1A1TSHRMAPK1MAPTGAA | |
| SCHEMBL28473501 | 0.79 | ALDH1A1 (0.46) | ALDH1A1TSHRMAPK1MAPTGAA | |
| SCHEMBL23633829 | 0.78 | CYP3A4 (0.47) | ALDH1A1TSHRMAPK1MAPTPOLB | |
| SCHEMBL28541195 | 0.78 | ALDH1A1 (0.44) | ALDH1A1TSHRMAPK1MAPTGAA | |
| SCHEMBL28793291 | 0.76 | ALDH1A1 (0.42) | ALDH1A1TSHRMAPK1MAPTGAA | |
| SCHEMBL26357499 | 0.76 | ALDH1A1 (0.49) | ALDH1A1TSHRMAPK1MAPTGAA |
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-20120130000-A1 | HYDROPHOBICALLY MODIFIED ALKYLENE OXIDE URETHANE POLYMER | ROHM AND HAAS COMPANY | 2012-05-24 | — | — | US | disclosed |