Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 8/20 | 0.38 |
| ▸ | CTSC | P53634 | 2/20 | 0.37 |
| ▸ | AVPR1A | P37288 | 3/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | CCNC | P24863 | 1/20 | 0.32 |
| ▸ | CDK8 | P49336 | 1/20 | 0.32 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.32 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.32 |
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 SCHEMBL6820160 | 0.85 | SIGMAR1 (0.41) | SIGMAR1NPY5RCTSCAVPR1ADRD2 | |
| SCHEMBL22057308 | 0.81 | NPY5R (0.45) | SIGMAR1NPY5RCTSCAVPR1A | |
| Hydrochloric Acid SCHEMBL6820680 | 0.80 | NPY5R (0.44) | SIGMAR1NPY5RCTSCAVPR1ADRD2 | |
| SCHEMBL3839131 | 0.78 | AVPR1A (0.50) | SIGMAR1NPY5RAVPR1A | |
| SCHEMBL18373156 | 0.78 | NPY5R (0.45) | SIGMAR1NPY5RCTSCAVPR1ADRD2 | |
| Hydrochloric Acid SCHEMBL6819610 | 0.77 | AVPR1A (0.49) | SIGMAR1CTSCAVPR1ADRD2CCNC | |
| SCHEMBL29674557 | 0.76 | SIGMAR1 (0.54) | SIGMAR1NPY5RAVPR1A | |
| SCHEMBL171980 | 0.76 | SIGMAR1 (0.54) | SIGMAR1NPY5RAVPR1A | |
| SCHEMBL736508 | 0.75 | AVPR1A (0.53) | NPY5RAVPR1A | |
| SCHEMBL30476248 | 0.75 | SIGMAR1 (0.36) | SIGMAR1NPY5RCTSCAVPR1ADRD2 |
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-1904477-A1 | INDOL-3-CARBONYL-SPIRO-PIPERIDINE DERIVATIVES AS V1A RECEPTOR ANTAGONISTS | F. Hoffmann-Roche AG (CH) | 2008-04-02 | — | — | EP | disclosed |
| WO-2007006688-A1 | INDOL-3-CARBONYL-SPIRO-PIPERIDINE DERIVATIVES AS V1A RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2007-01-18 | — | — | WO | disclosed |