Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 4/20 | 0.38 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.36 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.36 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.36 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 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 | |
|---|---|---|---|---|
| SCHEMBL8558877 | 0.84 | CNR1 (0.41) | CHRNB2CHRNA4CHRNA7APOBEC3AAPOBEC3G | |
| SCHEMBL8557069 | 0.83 | HRH4 (0.39) | MAPTALDH1A1KMT2ATDP1 | |
| Iodide SCHEMBL11193504 | 0.75 | CHRNB2 (0.52) | CHRNB2CHRNA4CHRNA7PABPC1APOBEC3A | |
| SCHEMBL724930 | 0.67 | CHRNB2 (0.61) | CHRNB2CHRNA4CHRNA7PABPC1APOBEC3A | |
| SCHEMBL10256901 | 0.67 | CHRNB2 (0.61) | CHRNB2CHRNA4CHRNA7PABPC1APOBEC3A | |
| SCHEMBL30066585 | 0.67 | CYP2A6 (0.50) | MAPTALDH1A1CYP2A6TSHRHSD17B10 | |
| SCHEMBL8050013 | 0.67 | HSD17B10 (0.50) | MAPTALDH1A1CYP2A6TSHRHSD17B10 | |
| SCHEMBL6267184 | 0.67 | CYP2A6 (0.50) | MAPTALDH1A1CYP2A6TSHRHSD17B10 | |
| SCHEMBL30367845 | 0.67 | HSD17B10 (0.50) | MAPTALDH1A1CYP2A6TSHRHSD17B10 | |
| Water SCHEMBL723735 | 0.66 | CHRNB2 (0.59) | CHRNB2CHRNA4CHRNA7PABPC1APOBEC3A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0685456-B1 | Bisquaternary ammonium derivatives of 2,2'-dimethyl-1,1'binaphtyl and process for their preparation | HOECHST AG (DE) | 1998-04-15 | — | — | EP | claimed |
| US-5599989-A | Bisquaternary ammonium compounds of 2,2'-dimethyl-1,1'-binaphythyl and process for their preparation | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-02-04 | — | — | US | claimed |
| US-5599989-A | Bisquaternary ammonium compounds of 2,2'-dimethyl-1,1'-binaphythyl and process for their preparation | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-02-04 | — | — | US | disclosed |