Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.60 |
| ▸ | PTGIR | P43119 | 4/20 | 0.58 |
| ▸ | HTR2A | P28223 | 2/20 | 0.57 |
| ▸ | ACHE | P22303 | 1/20 | 0.55 |
| ▸ | CCR5 | P51681 | 1/20 | 0.53 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5758647 | 0.83 | CCR5 (0.67) | PTGIRACHECCR5 | |
| SCHEMBL5758121 | 0.83 | ADRA2C (0.61) | PTGIRHTR2AACHEADRA2CKDM4E | |
| SCHEMBL28602611 | 0.82 | KCNH2 (0.64) | KCNH2ACHECCR5 | |
| SCHEMBL5758044 | 0.82 | KCNH2 (0.62) | KCNH2HTR2AKDM4ECYP1A2CYP3A4 | |
| SCHEMBL5758945 | 0.81 | KCNH2 (0.54) | KCNH2HTR2ACCR5 | |
| SCHEMBL8710869 | 0.80 | ACHE (0.56) | PTGIRHTR2AACHEKDM4ECYP1A2 | |
| SCHEMBL5757056 | 0.79 | KCNH2 (0.56) | KCNH2HTR2AKDM4ECYP1A2CYP3A4 | |
| SCHEMBL7250766 | 0.79 | KCNH2 (0.72) | KCNH2HTR2AKDM4ECYP1A2CYP3A4 | |
| SCHEMBL8313722 | 0.78 | KCNH2 (0.71) | KCNH2HTR2AKDM4ECYP1A2CYP3A4 | |
| SCHEMBL8664405 | 0.77 | PTGIR (0.50) | KCNH2PTGIRHTR2AACHEHRH3 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1401821-A4 | NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS | SK CORP (KR) | 2006-05-31 | — | — | EP | claimed |
| EP-1401821-A1 | NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS | SK Corporation (KR) | 2004-03-31 | — | — | EP | claimed |
| WO-2002100848-A1 | NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS | SK CORPORATION (KR) | 2002-12-19 | — | — | WO | claimed |
| EP-1401821-A4 | NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS | SK CORP (KR) | 2006-05-31 | — | — | EP | disclosed |
| EP-1401821-A1 | NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS | SK Corporation (KR) | 2004-03-31 | — | — | EP | disclosed |
| WO-2002100848-A1 | NOVEL PHENYLALKYL DIAMINE AND AMIDE ANALOGS | SK CORPORATION (KR) | 2002-12-19 | — | — | WO | disclosed |