Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 3/20 | 0.43 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.39 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.39 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.39 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11821323 | 0.87 | TSHR (0.48) | ALDH1A1TSHRAOC3MGLLCA2 | |
| SCHEMBL22016404 | 0.83 | TAS2R14 (0.42) | ALDH1A1TSHRAOC3MGLLCA2 | |
| SCHEMBL11824119 | 0.78 | KCNH2 (0.49) | MAOBOPRK1KCNH2 | |
| SCHEMBL3249918 | 0.76 | MGLL (0.45) | ALDH1A1TSHRAOC3MGLLCA2 | |
| SCHEMBL3239638 | 0.76 | TSHR (0.56) | ALDH1A1TSHRAOC3MGLLCA2 | |
| SCHEMBL3237296 | 0.76 | ALDH1A1 (0.44) | ALDH1A1TSHRAOC3MGLLG6PC1 | |
| SCHEMBL3251335 | 0.76 | AOC3 (0.52) | ALDH1A1TSHRAOC3MGLLG6PC1 | |
| SCHEMBL26802 | 0.75 | ALDH1A1 (0.48) | ALDH1A1TSHRAOC3G6PC1CA2 | |
| SCHEMBL479292 | 0.75 | TSHR (0.54) | ALDH1A1TSHRAOC3MGLLG6PC1 | |
| SCHEMBL266738 | 0.75 | ALDH1A1 (0.48) | ALDH1A1TSHRAOC3MGLLG6PC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20170114155-A1 | CHEMICALLY FUNCTIONALIZED RENEWED RUBBER COMPOSITION | LEHIGH TECHNOLOGIES, INC. (US) | 2017-04-27 | — | — | US | disclosed |
| US-5969150-A | FLUORESCENT COMPOUNDS FOR MEDICAL DIAGNOSIS, DRUGS AND LABELS OR FUNGICIDES AND VIRICIDES | THE ROCKEFELLER UNIVERSITY (US) | 1999-10-19 | — | — | US | disclosed |
| EP-0104432-A2 | Herbicide and plant growth regulator comprising alpha-beta-unsaturated compound | TEIJIN LIMITED (JP) | 1984-04-04 | — | — | EP | disclosed |