Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.42 |
| ▸ | SCN1A | P35498 | 3/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.38 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HTR2C | P28335 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HRH2 | P25021 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8443999 | 0.83 | SIGMAR1 (0.43) | SIGMAR1HTR2CHTTTSHRHTR2A | |
| SCHEMBL8444213 | 0.77 | SIGMAR1 (0.41) | SIGMAR1HTR2CHTTTSHRHTR2A | |
| SCHEMBL1506171 | 0.73 | SIGMAR1 (0.48) | SIGMAR1SCN1ASCN2ASCN3ALMNA | |
| SCHEMBL8444215 | 0.71 | SIGMAR1 (0.47) | SIGMAR1LMNAHTR2CHTTTSHR | |
| SCHEMBL1604070 | 0.71 | SIGMAR1 (0.50) | SIGMAR1LMNAHTR2CTSHRHTR2A | |
| SCHEMBL16597969 | 0.67 | SLC6A2 (0.50) | SIGMAR1SCN1ASCN2ASCN3ALMNA | |
| SCHEMBL18989478 | 0.67 | SLC6A2 (0.50) | SIGMAR1SCN1ASCN2ASCN3ALMNA | |
| SCHEMBL4667564 | 0.66 | SCN1A (0.65) | SIGMAR1SCN1ASCN2ASCN3ALMNA | |
| SCHEMBL19368242 | 0.64 | HPGD (0.41) | SCN1ASCN2ASCN3ALMNAHTR2C | |
| SCHEMBL971721 | 0.63 | SLC6A2 (0.60) | CYP2D6SLC6A2SLC6A4SLC6A3 |
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-5994374-A | Substituted 1-indolylpropyl-4-benzyl-tetrahydropyridine derivatives | MERCK SHARP & DOHME LTD. (GB) | 1999-11-30 | — | — | US | disclosed |