Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.32 |
| ▸ | FEN1 | P39748 | 2/20 | 0.32 |
| ▸ | REN | P00797 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.31 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.31 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.31 |
| ▸ | TACR3 | P29371 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3648728 | 0.88 | SLC6A4 (0.34) | RENKDM1ASLC6A4 | |
| SCHEMBL1507378 | 0.83 | SLC6A4 (0.33) | RENKDM1ASLC6A4 | |
| SCHEMBL3649427 | 0.82 | HTR1A (0.35) | RENKDM1ACYP2D6SLC6A4 | |
| SCHEMBL1439498 | 0.79 | KDM1A (0.37) | RENKDM1ATACR3SLC6A4 | |
| SCHEMBL3646382 | 0.79 | KDM1A (0.37) | RENKDM1ATACR3SLC6A4 | |
| SCHEMBL3647132 | 0.78 | KDM1A (0.40) | RENKDM1ATACR3SLC6A4 | |
| SCHEMBL1439365 | 0.75 | HTT (0.37) | KDM1ACYP2D6SLC6A4 | |
| SCHEMBL3650687 | 0.75 | TACR3 (0.34) | KDM1ACYP2D6DPP4DPP8DPP9 | |
| SCHEMBL3647536 | 0.73 | TACR3 (0.33) | KDM1ACYP2D6DPP4DPP8DPP9 | |
| SCHEMBL3712361 | 0.71 | KDM1A (0.38) | RENKDM1ATACR3SLC6A4 |
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-2470524-A1 | PYRROLIDINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | F. Hoffmann-La Roche AG (CH) | 2012-07-04 | — | — | EP | disclosed |
| WO-2011023626-A1 | PYRROLIDINE DERIVATIVES AS NK3 RECEPTOR ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2011-03-03 | — | — | WO | disclosed |