Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNA5 | P30532 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.36 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.36 |
| ▸ | HTR3B | O95264 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.36 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.36 |
| ▸ | SCN1A | P35498 | 1/20 | 0.36 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.36 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27917124 | 0.80 | CHRM2 (0.46) | CHRM2CHRM4CHRM1CHRM3CHRNA7 | |
| SCHEMBL9640284 | 0.80 | CHRM2 (0.46) | CHRM2CHRM4CHRM1CHRM3CHRNA7 | |
| SCHEMBL1851579 | 0.68 | KMT2A (0.39) | SCN1ASCN2ASCN3AMEN1KMT2A | |
| SCHEMBL5790059 | 0.65 | ALDH1A1 (0.40) | KMT2A | |
| SCHEMBL467252 | 0.64 | CYP1A2 (0.45) | HTR3EHTR3BHTR3AHTR3DHTR3C | |
| SCHEMBL6017223 | 0.64 | CYP2D6 (0.46) | CHRNA7CHRNB2CHRNA5CHRNA4HTR3E | |
| SCHEMBL7497538 | 0.62 | CHRNA7 (0.46) | CHRM2CHRM4CHRM1CHRM3CHRNA7 | |
| SCHEMBL7497532 | 0.62 | CHRNA7 (0.46) | CHRM2CHRM4CHRM1CHRM3CHRNA7 | |
| SCHEMBL374008 | 0.62 | LMNA (0.47) | KMT2A | |
| SCHEMBL7596827 | 0.61 | LMNA (0.39) | CHRM2CHRM4CHRM1CHRM3CHRNA7 |
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 |
|---|---|---|---|---|---|---|---|
| US-5817770-A | N-METHYLTROPANE, 2-CARBOXYETHYL- OR N-ETHYLCARBOXAMIDE, 3-BENZOYLOXY- OR BENZAMIDO- | DRUG ABUSE SCIENCES, INC. (US) | 1998-10-06 | — | — | US | claimed |