Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | DAO | P14920 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17499351 | 0.88 | CA1 (0.31) | SIGMAR1 | |
| SCHEMBL17499425 | 0.87 | GRIN2B (0.40) | SIGMAR1KCNH2HRH3TAAR1CYP1A2 | |
| SCHEMBL17499422 | 0.87 | GRIN2B (0.40) | SIGMAR1KCNH2HRH3TAAR1CYP1A2 | |
| SCHEMBL28039868 | 0.79 | SIGMAR1 (0.43) | SIGMAR1KCNH2HRH3TAAR1ALDH1A1 | |
| SCHEMBL17499453 | 0.77 | SIGMAR1 (0.42) | SIGMAR1KCNH2HRH3TAAR1CYP1A2 | |
| SCHEMBL16097740 | 0.76 | TAAR1 (0.44) | SIGMAR1KCNH2HRH3TAAR1CYP1A2 | |
| SCHEMBL17499786 | 0.75 | SIGMAR1 (0.43) | SIGMAR1KCNH2HRH3TAAR1CYP1A2 | |
| SCHEMBL17499113 | 0.75 | SIGMAR1 (0.43) | SIGMAR1KCNH2HRH3TAAR1CYP1A2 | |
| SCHEMBL28039851 | 0.75 | SIGMAR1 (0.46) | SIGMAR1KCNH2HRH3TAAR1AOC3 | |
| SCHEMBL17499451 | 0.75 | SRC (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2969593-B1 | POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES | BRIDGESTONE CORP (JP) | 2020-11-04 | — | — | EP | disclosed |
| US-9850328-B2 | Polymers functionalized with heterocyclic imines | BRIDGESTONE CORPORATION (JP) | 2017-12-26 | — | — | US | disclosed |
| US-20160039958-A1 | Polymers Functionalized With Heterocyclic Imines | BRIDGESTONE CORPORATION (JP) | 2016-02-11 | — | — | US | disclosed |