Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.48 |
| ▸ | STAT3 | P40763 | 1/20 | 0.44 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.42 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.34 |
| ▸ | MAOA | P21397 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11426669 | 0.82 | IDO1 (0.41) | ESR1ESR2TAAR1IDO1 | |
| SCHEMBL5772788 | 0.78 | ADRB2 (0.50) | TDP1IDO1SMN1; SMN2 | |
| SCHEMBL7750798 | 0.78 | ESR1 (0.59) | TDP1CYP2C19ESR1ESR2TAAR1 | |
| SCHEMBL6704370 | 0.77 | TAAR1 (0.58) | TAAR1 | |
| SCHEMBL190310 | 0.77 | ACHE (0.50) | ACHESTAT3GRIA4CHRNA7TDP1 | |
| SCHEMBL3533562 | 0.77 | CHRNA7 (0.42) | ACHECHRNA7TDP1CYP2C19IDO1 | |
| SCHEMBL184799 | 0.77 | TAAR1 (0.58) | TAAR1 | |
| SCHEMBL6327571 | 0.77 | ACHE (0.50) | ACHESTAT3GRIA4CHRNA7TDP1 | |
| SCHEMBL5490041 | 0.77 | ACHE (0.50) | ACHESTAT3GRIA4CHRNA7TDP1 | |
| SCHEMBL25489307 | 0.75 | ACHE (0.48) | ACHESTAT3GRIA4CHRNA7TDP1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1131235-C | 11 beta-halogen-7 alpha-substituted estratrienes, method for producing pharmaceutical preparations containing said 11 beta-halogen-7 alpha-substituted estratrienes, and use of said substances for producing medicaments | SCHERING AG (DE) | 2003-12-17 | — | — | CN | disclosed |
| CN-1286693-A | 11 'beta'-halogen-7 'alpha'-substd estratrienes, method for producing pharmaceutical preparations contg. said 11 'beta'-halogen-7 'alpha'-substd estratrienes and use of same for producing medicaments | SCHERING AG (DE) | 2001-03-07 | — | — | CN | disclosed |
| EP-0412551-B1 | Process for producing alpha, beta-unsaturated aldehyde | KURARAY CO (JP) | 1995-06-28 | — | — | EP | disclosed |
| US-5053552-A | Process for producing α,β-unsaturated aldehyde | KURARAY COMPANY, LTD. (JP) | 1991-10-01 | — | — | US | disclosed |
| EP-0412551-A2 | Process for producing alpha, beta-unsaturated aldehyde | KURARAY CO., LTD. (JP) | 1991-02-13 | — | — | EP | disclosed |
| US-4136100-A | BLUE-VIOLET TO GREEN-BLUE DYEINGS ON CELLULOSE TEXTILES | BASF AKTIENGESELLSCHAFT (DE) | 1979-01-23 | — | — | US | disclosed |