Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 5/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15901529 | 0.84 | THRB (0.55) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL15361864 | 0.81 | THRB (0.47) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL25385324 | 0.80 | THRB (0.51) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL22047091 | 0.80 | THRB (0.51) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL29161128 | 0.80 | THRB (0.51) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL24709495 | 0.79 | THRB (0.60) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL21837194 | 0.77 | CHRNB2 (0.57) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL29942360 | 0.77 | THRB (0.48) | THRBTSHRALDH1A1CYP3A4HPGD | |
| SCHEMBL29161102 | 0.76 | TSHR (0.50) | THRBTSHRALDH1A1CYP3A4HPGD | |
| Hydrochloric Acid SCHEMBL19281720 | 0.76 | CHRNB2 (0.56) | THRBTSHRALDH1A1CYP3A4HPGD |
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-4923930-A | VINYLALKOXYSILANE, POLYSILOXANE, VINYL EPOXIDE | KANSAI PAINT COMPANY, LIMITED (JP) | 1990-05-08 | — | — | US | disclosed |