Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.36 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.36 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.36 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL10935996 | 0.79 | TSHR (0.39) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL9114448 | 0.75 | KCNH2 (0.44) | KCNH2OPRM1DRD3CARM1PRMT6 | |
| SCHEMBL4186050 | 0.74 | BCHE (0.44) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL5950260 | 0.74 | TSHR (0.42) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL3868886 | 0.73 | TSHR (0.52) | ADRA2CKCNH2CHRM2HTR1AADRA2A | |
| SCHEMBL28072533 | 0.72 | CARM1 (0.50) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL14398133 | 0.72 | ADRA2C (0.45) | ADRA2CTSHR | |
| Hydrochloric Acid SCHEMBL7104055 | 0.72 | TSHR (0.50) | ADRA2CKCNH2CHRM2HTR1AADRA2A | |
| Hydrochloric Acid SCHEMBL8619258 | 0.72 | TSHR (0.50) | ADRA2CKCNH2CHRM2HTR1AADRA2A | |
| SCHEMBL6860839 | 0.71 | TSHR (0.50) | KCNH2CHRM2HTR1AADRA2ACHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4500452-A | NOT SUBJECT TO ENZYME DEACTIVATION | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1985-02-19 | — | — | US | disclosed |
| US-4472304-A | CARCINOSTATIC | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1984-09-18 | — | — | US | disclosed |