Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8555519 | 0.83 | CHRNB2 (0.38) | KMT2AALDH1A1MAPTTDP1 | |
| SCHEMBL8558877 | 0.81 | CNR1 (0.41) | KMT2AMEN1KDM4EALDH1A1LMNA | |
| SCHEMBL7776562 | 0.71 | MC4R (0.48) | KMT2AMEN1MAPK1 | |
| SCHEMBL30066585 | 0.64 | CYP2A6 (0.50) | ALDH1A1MAPTTDP1CYP2C19 | |
| SCHEMBL6267184 | 0.64 | CYP2A6 (0.50) | ALDH1A1MAPTTDP1CYP2C19 | |
| SCHEMBL8050013 | 0.64 | HSD17B10 (0.50) | ALDH1A1MAPTTDP1CYP2C19 | |
| SCHEMBL30367845 | 0.64 | HSD17B10 (0.50) | ALDH1A1MAPTTDP1CYP2C19 | |
| SCHEMBL15367682 | 0.63 | CHRNA7 (0.43) | KMT2AMEN1HTR6ALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL8349700 | 0.63 | CYP1A2 (0.40) | KMT2AMEN1ALDH1A1LMNAGAA | |
| SCHEMBL5691676 | 0.62 | ALDH1A1 (0.48) | ALDH1A1MAPTTDP1CYP2C19 |
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 |