Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 15/20 | 0.57 |
| ▸ | PANK3 | Q9H999 | 4/20 | 0.52 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL12517729 | 0.84 | TACR3 (0.61) | TACR3PANK3 | |
| SCHEMBL2017867 | 0.84 | PANK3 (0.57) | TACR3PANK3RIPK1 | |
| SCHEMBL15751845 | 0.80 | TACR3 (0.67) | TACR3 | |
| SCHEMBL6903622 | 0.79 | TACR3 (0.63) | TACR3 | |
| SCHEMBL15751844 | 0.79 | TACR3 (0.58) | TACR3RIPK1 | |
| SCHEMBL1439412 | 0.75 | TACR3 (0.57) | TACR3 | |
| SCHEMBL12789428 | 0.75 | TACR3 (0.61) | TACR3 | |
| SCHEMBL1439342 | 0.75 | TACR3 (0.61) | TACR3 | |
| SCHEMBL1439340 | 0.75 | TACR3 (0.61) | TACR3 | |
| SCHEMBL1978749 | 0.74 | TACR3 (0.84) | TACR3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011073160-A1 | PYRROLIDINE DERIVATIVES AS NK - 3 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-06-23 | — | — | WO | claimed |
| WO-2011073160-A1 | PYRROLIDINE DERIVATIVES AS NK - 3 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-06-23 | — | — | WO | disclosed |