Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.55 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.55 |
| ▸ | DRD2 | P14416 | 1/20 | 0.55 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.55 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.55 |
| ▸ | HTR2C | P28335 | 1/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | HRH1 | P35367 | 1/20 | 0.55 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.55 |
| ▸ | DRD3 | P35462 | 1/20 | 0.55 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.55 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL11387356 | 0.86 | CYP3A4 (0.49) | CYP3A4CYP2D6CYP1A2CYP2C9ALOX15 | |
| SCHEMBL3472567 | 0.83 | KDM4E (0.43) | HIF1AKDM4E | |
| SCHEMBL10674358 | 0.79 | CYP3A4 (0.42) | CYP3A4CYP2D6CYP1A2CYP2C9ALOX15 | |
| SCHEMBL10674369 | 0.79 | CYP3A4 (0.42) | CYP3A4CYP2D6CYP1A2CYP2C9ALOX15 | |
| SCHEMBL11387065 | 0.78 | CYP3A4 (0.42) | CYP3A4CYP2D6CYP1A2CYP2C9ALOX15 | |
| SCHEMBL11382307 | 0.78 | CYP1A2 (0.48) | CYP3A4CYP2D6CYP1A2CYP2C9ALOX15 | |
| SCHEMBL11383256 | 0.77 | CYP3A4 (0.41) | CYP3A4CYP2D6CYP1A2CYP2C9ALOX15 | |
| SCHEMBL11583146 | 0.76 | SIGMAR1 (0.67) | CYP2D6HRH1 | |
| SCHEMBL27275148 | 0.76 | ALDH1A1 (0.41) | HIF1ATDP1KDM4E | |
| SCHEMBL28198796 | 0.76 | ALDH1A1 (0.41) | HIF1ATDP1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-104334629-B | Rubber composition for tire tread and pneumatic tire | 住友橡胶工业株式会社 | 2016-08-24 | — | — | CN | disclosed |
| CN-104334629-A | Tread rubber composition and pneumatic tire | SUMITOMO RUBBER IND | 2015-02-04 | — | — | CN | disclosed |