Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5199385 | 0.84 | ALDH1A1 (0.46) | ALDH1A1TSHRHDAC8CHRNB2CHRNB4 | |
| SCHEMBL6682418 | 0.80 | ALDH1A1 (0.46) | ALDH1A1TSHRHDAC8CHRNB2CHRNB4 | |
| SCHEMBL20543582 | 0.77 | ALDH1A1 (0.52) | ALDH1A1TSHRHDAC8CHRNB2CHRNB4 | |
| SCHEMBL1474017 | 0.74 | ALDH1A1 (0.48) | ALDH1A1TSHRHDAC8CHRNB2CHRNB4 | |
| SCHEMBL705273 | 0.73 | MAPK1 (0.46) | ALDH1A1TSHRHDAC8 | |
| SCHEMBL1024017 | 0.72 | ALDH1A1 (0.58) | ALDH1A1TSHRHDAC8CHRNB2CHRNB4 | |
| SCHEMBL15198 | 0.72 | ALDH1A1 (0.58) | ALDH1A1TSHRHDAC8TDP1 | |
| Methoxymethane SCHEMBL28668345 | 0.71 | ALDH1A1 (0.50) | ALDH1A1TSHRHDAC8TRPA1 | |
| SCHEMBL29257290 | 0.71 | ALDH1A1 (0.73) | ALDH1A1TSHRHDAC8CHRNB2CHRNB4 | |
| SCHEMBL5197981 | 0.70 | ALDH1A1 (0.39) | ALDH1A1TSHRHDAC8CHRNB2CHRNB4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0688341-B1 | BUTADIENE POLYMERS HAVING TERMINAL SILYL GROUPS | SHELL INT RESEARCH (NL) | 1997-06-11 | — | — | EP | disclosed |
| EP-0688341-A1 | BUTADIENE POLYMERS HAVING TERMINAL SILYL GROUPS | SHELL INT RESEARCH (NL) | 1995-12-27 | — | — | EP | disclosed |
| WO-1994020553-A1 | BUTADIENE POLYMERS HAVING TERMINAL SILYL GROUPS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1994-09-15 | — | — | WO | disclosed |
| US-5336726-A | Butadiene polymers having terminal silyl groups | SHELL OIL COMPANY (US) | 1994-08-09 | — | — | US | disclosed |