Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.47 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL479294 | 0.95 | TSHR (0.50) | TSHRALDH1A1CNR2AOC3TRPA1 | |
| SCHEMBL3376047 | 0.86 | CNR2 (0.55) | TSHRALDH1A1CNR2AOC3SLC6A2 | |
| SCHEMBL134524 | 0.83 | TSHR (0.60) | TSHRALDH1A1CNR2AOC3TRPA1 | |
| SCHEMBL3372139 | 0.83 | HRH3 (0.53) | TSHRALDH1A1CNR2OPRK1KDM4E | |
| SCHEMBL22749514 | 0.81 | KDM4E (0.50) | TSHRALDH1A1CNR2SLC6A2SLC6A4 | |
| Fluoride SCHEMBL633879 | 0.80 | CNR2 (0.58) | TSHRALDH1A1CNR2AOC3TRPA1 | |
| Hydrochloric Acid SCHEMBL2137949 | 0.80 | CNR2 (0.58) | TSHRALDH1A1CNR2AOC3TRPA1 | |
| Bromide SCHEMBL11212819 | 0.80 | CNR2 (0.58) | TSHRALDH1A1CNR2AOC3TRPA1 | |
| Bromide SCHEMBL6760453 | 0.80 | CNR2 (0.58) | TSHRALDH1A1CNR2AOC3TRPA1 | |
| Ammonia Solution, Strong SCHEMBL1348044 | 0.80 | CNR2 (0.58) | TSHRALDH1A1CNR2AOC3TRPA1 |
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-4166827-A | DENTAL PLAQUE | COOPER LABORATORIES, INC. (US) | 1979-09-04 | — | — | US | disclosed |
| US-4110328-A | Bis-carbamylguanidinoazaalkane antimicrobial compounds | COOPER LABORATORIES, INC. (US) | 1978-08-29 | — | — | US | disclosed |