Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.53 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.53 |
| ▸ | HTR1A | P08908 | 1/20 | 0.53 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.53 |
| ▸ | DRD1 | P21728 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.53 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.51 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 3/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30505454 | 0.88 | KCNH2 (0.55) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL10524794 | 0.87 | TSHR (0.64) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL6909639 | 0.85 | KCNH2 (0.66) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL28904547 | 0.83 | TSHR (0.55) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL6897648 | 0.82 | KCNH2 (0.61) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL6907393 | 0.82 | OPRM1 (0.52) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL11209028 | 0.82 | KCNH2 (0.41) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL2698252 | 0.81 | TSHR (0.55) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL10526946 | 0.80 | KCNH2 (0.58) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL11399637 | 0.80 | AOC3 (0.57) | KCNH2CHRM1NR1H2NR1H3TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4313872-A | MONDAZO AND DISAZO DYES | CASSELLA AKTIENGESELLSCHAFT (DE) | 1982-02-02 | — | — | US | disclosed |