Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28890321 | 0.92 | TSHR (0.46) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Di(Hydroxyethyl)Ether SCHEMBL4840428 | 0.92 | TSHR (0.52) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| SCHEMBL29232128 | 0.88 | MEN1 (0.48) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| SCHEMBL8585424 | 0.88 | MEN1 (0.48) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Di(Hydroxyethyl)Ether SCHEMBL3419109 | 0.86 | TSHR (0.59) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Butoxyethanol SCHEMBL8586413 | 0.86 | TSHR (0.50) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Di(Hydroxyethyl)Ether SCHEMBL6692088 | 0.83 | ALDH1A1 (0.65) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Butoxyethanol SCHEMBL28059776 | 0.82 | TSHR (0.65) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Butoxyethanol SCHEMBL8584938 | 0.82 | TSHR (0.71) | ALDH1A1TSHRMEN1KMT2ATHRB | |
| Propylene Glycol SCHEMBL9452025 | 0.82 | HSD17B10 (0.45) | ALDH1A1TSHRHSD17B10TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0886718-A1 | OIL AND GAS FIELD CHEMICALS | BP Chemicals Limited (GB) | 1998-12-30 | — | — | EP | claimed |
| WO-1997035095-A1 | OIL AND GAS FIELD CHEMICALS | BP CHEMICALS LIMITED (GB) | 1997-09-25 | — | — | WO | claimed |