Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 3/20 | 0.58 |
| ▸ | TLR7 | Q9NYK1 | 5/20 | 0.56 |
| ▸ | DAO | P14920 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4963836 | 0.84 | HTR6 (0.58) | HTR6TLR7DAOLMNAHTT | |
| SCHEMBL3851027 | 0.83 | HTR6 (0.59) | HTR6TLR7DAOLMNAHTT | |
| SCHEMBL3064318 | 0.82 | DAO (0.60) | HTR6DAOLMNAHTTMEN1 | |
| SCHEMBL23997220 | 0.81 | HTR6 (0.58) | HTR6TLR7DAOLMNAHTT | |
| SCHEMBL30345083 | 0.81 | HTR6 (0.58) | HTR6TLR7DAOLMNAHTT | |
| SCHEMBL30345091 | 0.79 | C5AR1 (0.49) | HTR6DAOLMNAHTTMEN1 | |
| SCHEMBL23997186 | 0.79 | C5AR1 (0.49) | HTR6DAOLMNAHTTMEN1 | |
| SCHEMBL6059432 | 0.78 | DAO (0.59) | DAOLMNAHTTMEN1KMT2A | |
| SCHEMBL6060247 | 0.77 | DAO (0.55) | DAOLMNAHTTALDH1A1SMN1; SMN2 | |
| SCHEMBL3859399 | 0.77 | DAO (0.53) | HTR6TLR7DAOLMNAHTT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1608627-B1 | BICYCLIC ANILIDE SPIROHYDANTOIN CGRP RECEPTOR ANTAGONISTS | MERCK & CO INC (US) | 2008-05-07 | — | — | EP | disclosed |
| US-7202251-B2 | Bicyclic anilide spirohydantoin CGRP receptor antagonists | MERCK & CO., INC. (US) | 2007-04-10 | — | — | US | disclosed |
| US-7202251-B2 | Bicyclic anilide spirohydantoin CGRP receptor antagonists | MERCK & CO., INC. (US) | 2007-04-10 | — | — | US | disclosed |