Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.31 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.31 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28767790 | 0.83 | HTR2A (0.40) | ALDH1A1HTR2AOPRM1TSHRSLC6A2 | |
| SCHEMBL2447412 | 0.81 | HTR2A (0.39) | HTR2AOPRM1TSHRSLC6A2SLC6A3 | |
| SCHEMBL29240149 | 0.81 | HTR2A (0.41) | ALDH1A1HTR2AOPRM1TSHRSLC6A2 | |
| SCHEMBL28745569 | 0.77 | HTR2A (0.40) | HTR2AOPRM1TSHRSLC6A2SLC6A3 | |
| SCHEMBL28805981 | 0.76 | OPRM1 (0.37) | ALDH1A1HTR2AOPRM1L3MBTL1TSHR | |
| SCHEMBL15410302 | 0.75 | HTR2A (0.36) | HTR2AOPRM1TSHRSLC6A2SLC6A3 | |
| SCHEMBL15090448 | 0.74 | ALDH1A1 (0.31) | ALDH1A1OPRM1KDM4ETSHRSLC6A2 | |
| SCHEMBL5385849 | 0.68 | HDAC4 (0.37) | ALDH1A1HTR2AOPRM1SLC6A2SLC6A3 | |
| SCHEMBL10880376 | 0.68 | OPRM1 (0.37) | ALDH1A1HTR2AOPRM1TSHRSLC6A2 | |
| SCHEMBL27825135 | 0.68 | TSHR (0.39) | HTR2AOPRM1TSHRSLC6A2SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1125054-C | Novel imidazolidine derivatives, their preparation, their use and pharmaceutical preparations comprising them | AVENTIS PHARMACEUTICS GMBH (DE) | 2003-10-22 | — | — | CN | disclosed |