Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 4/20 | 0.36 |
| ▸ | HTR1D | P28221 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | NQO1 | P15559 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL911247 | 0.89 | HTR1B (0.35) | HTR1BHTR1DCYP1A2ACHEERBB2 | |
| Trimethylammonium SCHEMBL5191404 | 0.88 | CYP1A2 (0.39) | HTR1BHTR1DCYP1A2ACHEERBB2 | |
| SCHEMBL50100 | 0.88 | CYP1A2 (0.43) | HTR1BCYP1A2ACHEERBB2FYN | |
| Ammonia Solution, Strong SCHEMBL8665916 | 0.87 | CYP1A2 (0.42) | HTR1BCYP1A2ACHEERBB2FYN | |
| Iodide SCHEMBL21834093 | 0.80 | THRA (0.35) | — | |
| SCHEMBL2374259 | 0.79 | HTR1B (0.38) | HTR1BHTR1DTSHRRXRAPPARG | |
| SCHEMBL16990771 | 0.79 | CYP1A2 (0.36) | CYP1A2ACHEERBB2FYNMAOA | |
| Iodide SCHEMBL21808443 | 0.78 | ERBB2 (0.33) | CYP1A2ACHEERBB2FYNMAOA | |
| SCHEMBL1158813 | 0.78 | CYP1A2 (0.32) | CYP1A2 | |
| Tetrahydrofuran SCHEMBL8033535 | 0.78 | CYP1A2 (0.35) | CYP1A2ACHEERBB2FYNMAOA |
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-20020039528-A1 | MGalloy member and its use | KATO TOMOYA (JP) | 2002-04-04 | — | — | US | disclosed |
| US-6328530-B1 | MG alloy member and its use | HITACHI, LTD. (JP) | 2001-12-11 | — | — | US | disclosed |
| EP-0943700-A2 | Mg alloy member, its fabrication and its use | Hitachi, Ltd. (JP) | 1999-09-22 | — | — | EP | disclosed |