Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 15/20 | 0.57 |
| ▸ | HCRTR2 | O43614 | 14/20 | 0.57 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.48 |
| ▸ | DPP4 | P27487 | 1/20 | 0.48 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3366901 | 0.87 | HCRTR1 (0.61) | HCRTR1HCRTR2USP30DPP4HSD11B1 | |
| SCHEMBL3366778 | 0.85 | HCRTR1 (0.58) | HCRTR1HCRTR2USP30DPP4HSD11B1 | |
| SCHEMBL3367428 | 0.85 | HCRTR1 (0.55) | HCRTR1HCRTR2NPC1RAB9A | |
| SCHEMBL3367310 | 0.84 | HCRTR1 (0.61) | HCRTR1HCRTR2HSD11B1 | |
| SCHEMBL3369211 | 0.83 | HCRTR1 (0.60) | HCRTR1HCRTR2USP30DPP4HSD11B1 | |
| SCHEMBL3370370 | 0.83 | HCRTR1 (0.60) | HCRTR1HCRTR2USP30DPP4HSD11B1 | |
| SCHEMBL3366195 | 0.82 | HCRTR1 (0.56) | HCRTR1HCRTR2USP30HSD11B1NPC1 | |
| SCHEMBL3370194 | 0.81 | GRM5 (0.60) | HCRTR1HCRTR2USP30DPP4 | |
| SCHEMBL3369475 | 0.81 | HCRTR1 (0.61) | HCRTR1HCRTR2USP30DPP4HSD11B1 | |
| SCHEMBL3368643 | 0.80 | HCRTR1 (0.53) | HCRTR1HCRTR2DPP4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1532141-B1 | 2-PYRROLIDIN-2-YL- [1,3,4]-OXADIAZOLE DERIVATIVES AND THE USE OF THE SAME AS ANTIDEPRESSANTS | GRUENENTHAL GMBH (DE) | 2010-10-13 | — | — | EP | disclosed |