Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6669828 | 0.82 | HTR2A (0.36) | OPRM1SIGMAR1KCNH2 | |
| Hydrochloric Acid SCHEMBL6668923 | 0.81 | HTR2A (0.35) | SIGMAR1 | |
| SCHEMBL6669198 | 0.75 | SIGMAR1 (0.38) | SIGMAR1 | |
| SCHEMBL6672759 | 0.73 | DRD2 (0.46) | — | |
| SCHEMBL6670052 | 0.72 | SIGMAR1 (0.38) | SIGMAR1 | |
| SCHEMBL10531104 | 0.71 | NOTUM (0.48) | NOTUMNAMPTCYP4F2CYP4A11 | |
| SCHEMBL6672242 | 0.71 | AKT1 (0.40) | — | |
| SCHEMBL6672515 | 0.71 | AKT1 (0.40) | — | |
| SCHEMBL14529886 | 0.69 | OPRM1 (0.45) | OPRM1SIGMAR1 | |
| SCHEMBL6670168 | 0.68 | DRD2 (0.38) | OPRM1SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1399432-A1 | SPIROPIPERIDINE COMPOUNDS AS LIGANDS FOR ORL-1 RECEPTOR | PFIZER INC. (US) | 2004-03-24 | — | — | EP | disclosed |
| WO-2003000677-A1 | SPIROPIPERIDINE COMPOUNDS AS LIGANDS FOR ORL-1 RECEPTOR | PFIZER PHARMACEUTICALS INC. (JP) | 2003-01-03 | — | — | WO | disclosed |