Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.35 |
| ▸ | EBP | Q15125 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 5/20 | 0.34 |
| ▸ | MMP3 | P08254 | 4/20 | 0.34 |
| ▸ | MMP13 | P45452 | 3/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | MMP12 | P39900 | 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 | |
|---|---|---|---|---|
| SCHEMBL11022689 | 0.79 | CYP1A2 (0.36) | SIGMAR1EBPMMP2MMP3 | |
| SCHEMBL11024418 | 0.75 | KCNH2 (0.35) | TAAR1SIGMAR1EBPOPRM1DRD3 | |
| SCHEMBL13061188 | 0.74 | TAAR1 (0.47) | TAAR1SIGMAR1 | |
| SCHEMBL13061073 | 0.74 | TAAR1 (0.47) | TAAR1SIGMAR1 | |
| SCHEMBL11022701 | 0.73 | SIGMAR1 (0.53) | SIGMAR1DRD2DRD4OPRM1DRD3 | |
| SCHEMBL11022704 | 0.71 | SIGMAR1 (0.57) | TAAR1SIGMAR1EBP | |
| SCHEMBL27999740 | 0.70 | SIGMAR1 (0.53) | TAAR1SIGMAR1 | |
| SCHEMBL11020152 | 0.68 | TAAR1 (0.47) | TAAR1SIGMAR1 | |
| SCHEMBL22117248 | 0.67 | SIGMAR1 (0.47) | TAAR1SIGMAR1MMP2MMP3 | |
| SCHEMBL22364527 | 0.67 | SLC6A2 (0.54) | TAAR1SIGMAR1 |
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 |