Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 3/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2394397 | 1.00 | OPRM1 (0.36) | OPRM1OPRL1OPRD1OPRK1GRIN2B | |
| SCHEMBL2390990 | 0.83 | CYP3A4 (0.39) | OPRM1OPRL1OPRD1OPRK1ALDH1A1 | |
| SCHEMBL2393742 | 0.81 | LMNA (0.37) | OPRM1OPRL1OPRD1OPRK1ALDH1A1 | |
| SCHEMBL2390242 | 0.76 | HSD17B10 (0.39) | OPRM1OPRL1OPRD1OPRK1ALDH1A1 | |
| SCHEMBL2388731 | 0.73 | HSD17B10 (0.41) | OPRM1OPRL1OPRD1OPRK1ALDH1A1 | |
| SCHEMBL2395152 | 0.70 | ACE2 (0.47) | MEN1KMT2A | |
| SCHEMBL3274411 | 0.68 | CYP1A2 (0.30) | — | |
| SCHEMBL2993414 | 0.68 | LMNA (0.40) | OPRM1OPRL1OPRD1OPRK1GRIN2B | |
| SCHEMBL2390240 | 0.68 | PREP (0.46) | MEN1KMT2ALMNA | |
| SCHEMBL2394393 | 0.67 | ACE2 (0.47) | LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-8013008-B2 | Cyclic amine compound | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-09-06 | — | — | US | disclosed |