Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 5/20 | 0.64 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.64 |
| ▸ | LTA4H | P09960 | 1/20 | 0.62 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.55 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.55 |
| ▸ | BLM | P54132 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL8023030 | 0.92 | SIGMAR1 (0.75) | DRD4SIGMAR1LTA4HCXCR3KCNH2 | |
| Phenol SCHEMBL10513506 | 0.87 | SIGMAR1 (0.68) | DRD4SIGMAR1LTA4HCXCR3KCNH2 | |
| Hydrochloric Acid SCHEMBL27514643 | 0.87 | DRD4 (0.56) | DRD4SIGMAR1CXCR3KCNH2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7989299 | 0.83 | SIGMAR1 (0.67) | DRD4SIGMAR1CXCR3 | |
| SCHEMBL3164487 | 0.83 | SIGMAR1 (0.74) | DRD4SIGMAR1 | |
| SCHEMBL11143623 | 0.82 | SIGMAR1 (0.62) | DRD4SIGMAR1LTA4HCXCR3KCNH2 | |
| SCHEMBL23366658 | 0.82 | KCNH2 (0.68) | SIGMAR1KCNH2ALDH1A1USP2BLM | |
| SCHEMBL27430491 | 0.80 | SIGMAR1 (0.79) | DRD4SIGMAR1CXCR3 | |
| SCHEMBL5175385 | 0.80 | MCHR1 (0.77) | SIGMAR1LTA4HKCNH2ALDH1A1USP2 | |
| SCHEMBL6702659 | 0.79 | KCNA3 (0.62) | DRD4SIGMAR1CXCR3 |
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-0052311-A1 | 1-((Benzoylphenyl) - lower-alkyl) piperidines and carbinol analogs and preparation thereof | STERLING DRUG INC. (US) | 1982-05-26 | — | — | EP | disclosed |