Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPB1 | P15086 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.43 |
| ▸ | AGTR2 | P50052 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL14040649 | 0.88 | AGTR2 (0.48) | CYP2C19HTR2CNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL20817351 | 0.81 | HTR2C (0.48) | CYP2C19POLBALDH1A1HTR2CNPC1 | |
| SCHEMBL20817350 | 0.81 | HTR2C (0.48) | CYP2C19POLBALDH1A1HTR2CNPC1 | |
| SCHEMBL26214885 | 0.81 | HTR2C (0.48) | CYP2C19POLBALDH1A1HTR2CNPC1 | |
| SCHEMBL2622088 | 0.79 | HTR2C (0.47) | CPB1CYP2C9CYP2C19POLBALDH1A1 | |
| SCHEMBL2115752 | 0.79 | HTR2C (0.47) | CPB1CYP2C9CYP2C19POLBALDH1A1 | |
| SCHEMBL16249919 | 0.79 | HTR2C (0.49) | CPB1CYP2C9CYP2C19POLBALDH1A1 | |
| SCHEMBL1864842 | 0.78 | POLB (0.52) | POLBALDH1A1HTR2CNPC1RAB9A | |
| SCHEMBL7802196 | 0.78 | POLB (0.52) | POLBALDH1A1HTR2CNPC1RAB9A | |
| SCHEMBL2300448 | 0.78 | POLB (0.52) | POLBALDH1A1HTR2CNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1411940-B1 | BRIDGED PIPERIDINE DERIVATIVES AS MELANOCORTIN RECEPTOR AGONISTS | MERCK & CO INC (US) | 2008-10-15 | — | — | EP | disclosed |