Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | MC4R | P32245 | 2/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.33 |
| ▸ | EBP | Q15125 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | FDPS | P14324 | 1/20 | 0.32 |
| ▸ | CCR4 | P51679 | 1/20 | 0.31 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11024413 | 0.77 | SIGMAR1 (0.46) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL11022708 | 0.75 | TAAR1 (0.36) | OPRM1DRD3SIGMAR1EBPTAAR1 | |
| SCHEMBL11024416 | 0.75 | SIGMAR1 (0.57) | KCNH2CHRM2HTR1AADRA2ACHRM1 | |
| SCHEMBL11022689 | 0.71 | CYP1A2 (0.36) | KCNH2SLC6A2SLC6A4SLC6A3SIGMAR1 | |
| SCHEMBL27999740 | 0.70 | SIGMAR1 (0.53) | KCNH2SLC6A2SLC6A4SLC6A3SIGMAR1 | |
| SCHEMBL11020152 | 0.68 | TAAR1 (0.47) | KCNH2SLC6A2SLC6A4SLC6A3SIGMAR1 | |
| SCHEMBL22117248 | 0.67 | SIGMAR1 (0.47) | SIGMAR1TAAR1 | |
| SCHEMBL13061188 | 0.64 | TAAR1 (0.47) | KCNH2SLC6A2SLC6A4SLC6A3SIGMAR1 | |
| SCHEMBL13061073 | 0.64 | TAAR1 (0.47) | KCNH2SLC6A2SLC6A4SLC6A3SIGMAR1 | |
| SCHEMBL22364527 | 0.64 | SLC6A2 (0.54) | KCNH2SLC6A2SLC6A4SLC6A3SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0082266-B1 | SUBSTITUTED 1,5-DIAMINOPENTANES, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | BASF Aktiengesellschaft (DE) | 1985-01-09 | — | — | EP | disclosed |