Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 3/20 | 0.50 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
| ▸ | GUSB | P08236 | 1/20 | 0.31 |
| ▸ | OPRD1 | P41143 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8199657 | 0.79 | CHRNB4 (0.54) | CHRNB4CHRNA3ACHEDRD2CA2 | |
| SCHEMBL8204827 | 0.79 | CA2 (0.50) | CHRNB4CHRNA3CA2ADRA1DADRA1A | |
| SCHEMBL9093837 | 0.78 | CHRNB4 (0.47) | CHRNB4CHRNA3NPC1 | |
| SCHEMBL8116022 | 0.75 | CHRNB4 (0.47) | CHRNB4CHRNA3CYP11B1CYP11B2NPC1 | |
| SCHEMBL1079302 | 0.72 | NISCH (0.48) | CHRNB4CHRNA3ADRA1DADRA1AADRA1B | |
| SCHEMBL461998 | 0.69 | ITGB2 (0.50) | CHRNB4CHRNA3 | |
| SCHEMBL118556 | 0.69 | ABCG2 (0.50) | CHRNB4CHRNA3 | |
| SCHEMBL11815059 | 0.67 | CHRNB4 (0.43) | CHRNB4CHRNA3ACHEDRD2CA2 | |
| SCHEMBL9534791 | 0.66 | KDM4E (0.42) | CHRNB4CHRNA3NPC1 | |
| SCHEMBL28861554 | 0.66 | CHRNB4 (0.38) | CHRNB4CHRNA3CA2ADRA1DADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000058301-A1 | N-[2-(4-AMINOPHYL)ETHYL]-2,3-DIHYDRO-1,4-BENZODIOXINE-2-METHANAMINE, PRODUCTION AND THERAPEUTIC USE THEREOF | SANOFI-SYNTHELABO (FR) | 2000-10-05 | — | — | WO | disclosed |