Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8966766 | 0.90 | ADRB2 (0.36) | CYP3A4ADRB2ADRB1ADRB3TSHR | |
| SCHEMBL8966223 | 0.88 | ADRB2 (0.35) | CYP3A4ADRB2ADRB1ADRB3TSHR | |
| SCHEMBL8404973 | 0.74 | CYP3A4 (0.40) | CYP3A4ADRB2ADRB1ADRB3TSHR | |
| SCHEMBL11504759 | 0.74 | CYP3A4 (0.40) | CYP3A4ADRB2ADRB1ADRB3TSHR | |
| SCHEMBL8966922 | 0.74 | ADRB2 (0.39) | CYP3A4ADRB2ADRB1ADRB3TSHR | |
| SCHEMBL14779460 | 0.74 | CYP3A4 (0.40) | CYP3A4ADRB2ADRB1ADRB3TSHR | |
| SCHEMBL8966618 | 0.73 | LPAR3 (0.40) | TSHRCA1CA2 | |
| SCHEMBL9500960 | 0.72 | CYP3A4 (0.39) | CYP3A4ADRB2ADRB1ADRB3TSHR | |
| SCHEMBL7565088 | 0.71 | CYP3A4 (0.34) | CYP3A4ADRB2ADRB1ADRB3TSHR | |
| SCHEMBL3360879 | 0.70 | CYP3A4 (0.42) | CYP3A4ADRB2ADRB1ADRB3TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8399570-B2 | Functionalized polymers and improved tires therefrom | BRIDGESTONE CORPORATION (JP) | 2013-03-19 | — | — | US | disclosed |
| US-20090326161-A1 | FUNCTIONALIZED POLYMERS AND IMPROVED TIRES THEREFROM | BRIDGESTONE CORPORATION (JP) | 2009-12-31 | — | — | US | disclosed |
| US-7598322-B1 | particularly tire treads exhibiting reduced rolling resistance; a vulcanized rubbery polymer such as polybutadiene-butadiene-styrene copolymer made from living polymerization using butyllithium initiator and a tributyloxyborane as polymerization terminator | BRIDGESTONE CORPORATION (JP) | 2009-10-06 | — | — | US | disclosed |