Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | PER2 | O15055 | 4/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.36 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL166065 | 0.94 | PIK3CD (0.48) | PER2CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL1570393 | 0.85 | CHRM2 (0.39) | PER2CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL12032481 | 0.79 | PER2 (0.50) | L3MBTL1PER2CHRM2CHRM4CHRM5 | |
| SCHEMBL21401133 | 0.78 | PER2 (0.49) | L3MBTL1PER2CHRM2CHRM4CHRM5 | |
| SCHEMBL20762080 | 0.78 | PER2 (0.49) | L3MBTL1PER2CHRM2CHRM4CHRM5 | |
| SCHEMBL13508581 | 0.78 | PER2 (0.49) | L3MBTL1PER2CHRM2CHRM4CHRM5 | |
| SCHEMBL13654900 | 0.76 | — | — | |
| SCHEMBL22323094 | 0.73 | P2RX7 (0.33) | — | |
| SCHEMBL342303 | 0.73 | PER2 (0.46) | L3MBTL1PER2CHRM2CHRM4CHRM5 | |
| SCHEMBL3834112 | 0.73 | KMT2A (0.60) | L3MBTL1PER2CHRM2CHRM4CHRM5 |
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-2637656-A1 | PIPERIDINONE CARBOXAMIDE INDANE CGRP RECEPTOR ANTAGONISTS | Merck Sharp & Dohme Corp. (US) | 2013-09-18 | — | — | EP | disclosed |
| WO-2012064911-A1 | PIPERIDINONE CARBOXAMIDE INDANE CGRP RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2012-05-18 | — | — | WO | disclosed |