Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 5/20 | 0.50 |
| ▸ | OPRK1 | P41145 | 5/20 | 0.50 |
| ▸ | OPRL1 | P41146 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL19953514 | 0.79 | OPRM1 (0.43) | OPRM1OPRK1OPRL1NOTUMMAPT | |
| SCHEMBL19953762 | 0.78 | ALDH1A1 (0.46) | ALDH1A1NOTUMMEN1KMT2AMAPT | |
| SCHEMBL3868736 | 0.78 | ALDH1A1 (0.46) | ALDH1A1NOTUMMEN1KMT2AMAPT | |
| SCHEMBL19960876 | 0.77 | OPRM1 (0.44) | OPRM1OPRK1OPRL1NOTUM | |
| SCHEMBL19953521 | 0.75 | CASP1 (0.45) | ALDH1A1NOTUMMEN1KMT2AMAPT | |
| SCHEMBL19953535 | 0.74 | OPRM1 (0.39) | OPRM1OPRK1OPRL1NOTUM | |
| SCHEMBL19953763 | 0.70 | HDAC4 (0.42) | ALDH1A1NOTUMMEN1KMT2A | |
| SCHEMBL30899464 | 0.67 | KDM4C (0.44) | OPRM1ALDH1A1NOTUM | |
| SCHEMBL16250257 | 0.67 | KDM4C (0.44) | OPRM1ALDH1A1NOTUM | |
| SCHEMBL28280809 | 0.67 | NOTUM (0.41) | OPRM1ALDH1A1NOTUMMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018047983-A1 | INDANE DERIVATIVES USEFUL AS MODULATORS OF MGLUR7 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-03-15 | — | — | WO | disclosed |