Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 10/20 | 1.00 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
| ▸ | EBP | Q15125 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9309563 | 0.92 | SIGMAR1 (0.97) | SIGMAR1PARP1 | |
| Hydrochloric Acid SCHEMBL9308175 | 0.91 | SIGMAR1 (1.00) | SIGMAR1PARP1 | |
| SCHEMBL7376361 | 0.86 | SIGMAR1 (1.00) | SIGMAR1PARP1 | |
| SCHEMBL9309721 | 0.83 | SIGMAR1 (0.97) | SIGMAR1PARP1 | |
| SCHEMBL10567502 | 0.76 | HTR1A (0.68) | SIGMAR1 | |
| SCHEMBL30296953 | 0.74 | ALDH1A1 (0.64) | SIGMAR1 | |
| SCHEMBL155413 | 0.74 | ALDH1A1 (0.64) | SIGMAR1 | |
| SCHEMBL7530169 | 0.73 | SIGMAR1 (0.97) | SIGMAR1PARP1 | |
| SCHEMBL17035450 | 0.72 | SIGMAR1 (0.74) | SIGMAR1 | |
| SCHEMBL9306818 | 0.69 | SIGMAR1 (0.64) | SIGMAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5254561-A | Tricyclic antipsychotic agents | MERCK SHARP & DOHME LIMITED (GB) | 1993-10-19 | — | — | US | disclosed |
| EP-0463691-A2 | Tricyclic sigma ligands | MERCK SHARP & DOHME LTD. (GB) | 1992-01-02 | — | — | EP | disclosed |