Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FGFR1 | P11362 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | NEK2 | P51955 | 1/20 | 0.34 |
| ▸ | CALCA | P06881 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 2/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.32 |
| ▸ | OTUD7B | Q6GQQ9 | 1/20 | 0.32 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 2/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | HRH2 | P25021 | 1/20 | 0.31 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | MET | P08581 | 4/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13342718 | 0.83 | GRIN2D (0.41) | OPRM1 | |
| SCHEMBL1700112 | 0.78 | CALCA (0.49) | CALCAOTUD7BMET | |
| SCHEMBL13747399 | 0.77 | BACE1 (0.37) | CALCAOPRM1MAP3K11 | |
| SCHEMBL15935945 | 0.76 | KCNH2 (0.38) | NEK2DRD4OPRM1OTUD7BHTR2B | |
| SCHEMBL15935918 | 0.75 | KCNH2 (0.39) | — | |
| SCHEMBL31349491 | 0.75 | OPRD1 (0.45) | OPRK1KDM4E | |
| SCHEMBL15935922 | 0.72 | CYP1A2 (0.37) | FGFR1CYP1A2CALCADRD4OPRM1 | |
| SCHEMBL15935920 | 0.72 | FGFR1 (0.38) | FGFR1CYP1A2NEK2CALCAMAP3K11 | |
| SCHEMBL31596938 | 0.70 | OPRD1 (0.41) | OPRK1 | |
| SCHEMBL31596896 | 0.70 | TET3 (0.40) | — |
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-8796260-B2 | Imidazobenzazepine CGRP receptor antagonists | MERCK SHARP & DOHME CORP. (US) | 2014-08-05 | — | — | US | disclosed |