Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | PRNP | P04156 | 3/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | FABP3 | P05413 | 1/20 | 0.34 |
| ▸ | FABP4 | P15090 | 1/20 | 0.34 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5262688 | 0.69 | ACP1 (0.39) | KDM4EPPARACYP2A6FAAHNPC1 | |
| SCHEMBL4066225 | 0.67 | SLC6A4 (0.47) | KDM4EALDH1A1PRNPCYP2A6TP53 | |
| SCHEMBL6415649 | 0.66 | CCNC (0.46) | KDM4EALDH1A1HPGDFAAHNPC1 | |
| SCHEMBL8889345 | 0.65 | MAPK1 (0.54) | KDM4EALDH1A1CYP2A6HPGDNPC1 | |
| SCHEMBL11880095 | 0.65 | LMNA (0.38) | KDM4EALDH1A1GAASMN1; SMN2MAPK1 | |
| SCHEMBL8559644 | 0.64 | MAPT (0.53) | KDM4EHPGDCYP1A2CYP2C19SMN1; SMN2 | |
| SCHEMBL8559109 | 0.64 | HTR3A (0.37) | RXFP1CYP2A6HPGDSMN1; SMN2TP53 | |
| SCHEMBL934918 | 0.63 | HTR3A (0.45) | KDM4EALDH1A1RXFP1CYP2A6MAPT | |
| SCHEMBL7905050 | 0.63 | MAPT (0.65) | KDM4EALDH1A1RXFP1NPSR1CYP2A6 | |
| SCHEMBL198060 | 0.63 | BACE1 (0.50) | ALDH1A1CYP2A6HTR3AHRH4 |
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-1824817-A1 | ARYLSULFONYLNAPHTHALENE DERIVATIVES AS 5HT2A ANTAGONISTS | MERCK SHARP & DOHME LTD. (GB) | 2007-08-29 | — | — | EP | disclosed |
| WO-2006059149-A1 | ARYLSULFONYLNAPHTHALENE DERIVATIVES AS 5HT2A ANTAGONISTS | MERCK SHARP & DOHME LIMITED (GB) | 2006-06-08 | — | — | WO | disclosed |