Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 5/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MC4R | P32245 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL2636383 | 1.00 | CYP2D6 (0.41) | CYP2D6OPRK1OPRL1OPRM1OPRD1 | |
| SCHEMBL869078 | 0.82 | CYP2D6 (0.36) | CYP2D6OPRK1OPRL1OPRM1OPRD1 | |
| SCHEMBL868802 | 0.81 | CYP2D6 (0.35) | CYP2D6OPRK1OPRL1OPRM1OPRD1 | |
| SCHEMBL868771 | 0.72 | CYP2D6 (0.50) | CYP2D6OPRK1OPRL1OPRM1OPRD1 | |
| SCHEMBL868770 | 0.72 | CYP2D6 (0.50) | CYP2D6OPRK1OPRL1OPRM1OPRD1 | |
| SCHEMBL10565433 | 0.70 | CYP2D6 (0.55) | CYP2D6OPRK1OPRL1OPRM1OPRD1 | |
| SCHEMBL28417009 | 0.69 | CHRM2 (0.41) | CYP2D6OPRK1OPRL1OPRM1OPRD1 | |
| SCHEMBL28414488 | 0.69 | CHRM2 (0.41) | CYP2D6OPRK1OPRL1OPRM1OPRD1 | |
| SCHEMBL28417011 | 0.69 | CHRM2 (0.41) | CYP2D6OPRK1OPRL1OPRM1OPRD1 | |
| SCHEMBL28414490 | 0.69 | CHRM2 (0.41) | CYP2D6OPRK1OPRL1OPRM1OPRD1 |
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-2437600-A1 | BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS | GlaxoSmithKline LLC (US) | 2012-04-11 | — | — | EP | disclosed |
| WO-2010141540-A1 | BIS-PYRIDYLPYRIDONES AS MELANIN-CONCENTRATING HORMONE RECEPTOR 1 ANTAGONISTS | GLAXOSMITHKLINE LLC (US) | 2010-12-09 | — | — | WO | disclosed |