Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.62 |
| ▸ | CHRM4 | P08173 | 11/20 | 0.59 |
| ▸ | CHRM5 | P08912 | 11/20 | 0.59 |
| ▸ | CHRM3 | P20309 | 11/20 | 0.59 |
| ▸ | CHRM2 | P08172 | 10/20 | 0.59 |
| ▸ | CHRM1 | P11229 | 10/20 | 0.59 |
| ▸ | BCL2 | P10415 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9716825 | 0.98 | CHRM4 (0.62) | SIGMAR1CHRM4CHRM5CHRM3CHRM2 | |
| SCHEMBL9716774 | 0.93 | SIGMAR1 (0.55) | SIGMAR1CHRM4CHRM5CHRM3CHRM2 | |
| Maleic Acid SCHEMBL9716787 | 0.90 | SIGMAR1 (0.52) | SIGMAR1CHRM4CHRM5CHRM3CHRM2 | |
| Fumaric Acid SCHEMBL9716792 | 0.90 | SIGMAR1 (0.52) | SIGMAR1CHRM4CHRM5CHRM3CHRM2 | |
| SCHEMBL9716891 | 0.86 | HTR2A (0.65) | SIGMAR1CHRM4CHRM5CHRM3CHRM2 | |
| SCHEMBL9720946 | 0.86 | SIGMAR1 (0.48) | SIGMAR1CHRM4CHRM5CHRM3CHRM2 | |
| SCHEMBL9716709 | 0.86 | BCL2 (0.50) | SIGMAR1CHRM4CHRM5CHRM3CHRM2 | |
| SCHEMBL9716867 | 0.86 | BCL2 (0.50) | SIGMAR1CHRM4CHRM5CHRM3CHRM2 | |
| Maleic Acid SCHEMBL9716839 | 0.85 | BCL2 (0.47) | SIGMAR1CHRM4CHRM5CHRM3CHRM2 | |
| Fumaric Acid SCHEMBL9716852 | 0.85 | BCL2 (0.47) | SIGMAR1CHRM4CHRM5CHRM3CHRM2 |
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 |
|---|---|---|---|---|---|---|---|
| JP-60132934-A | — | — | None | — | — | JP | disclosed |
| US-5089529-A | Antiarrhythmia agents | NIPPON SHINYAKU CO., LTD. (JP) | 1992-02-18 | — | — | US | disclosed |
| JP-S60132934-A | BUTANOL DERIVATIVE | NIPPON SHINYAKU CO LTD | 1985-07-16 | — | — | JP | disclosed |