Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | XDH | P47989 | 4/20 | 0.33 |
| ▸ | SLC22A12 | Q96S37 | 4/20 | 0.33 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.32 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | KCNE1 | P15382 | 3/20 | 0.32 |
| ▸ | KCNQ1 | P51787 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8314385 | 0.85 | ABCC9 (0.36) | ABCB1KDM4EABCC9KCNE1KCNQ1 | |
| SCHEMBL8312895 | 0.83 | GABRA1 (0.37) | PTGS2ABCC9CYP2C9KCNE1KCNQ1 | |
| SCHEMBL8316738 | 0.82 | ABCC9 (0.32) | ABCC9 | |
| SCHEMBL8316452 | 0.76 | OPRD1 (0.35) | KDM4ECYP2C9MEN1CYP1A2CYP2C19 | |
| SCHEMBL8137883 | 0.74 | PTGS2 (0.34) | PTGS2HTR2APTGDR2CYP3A4KCNE1 | |
| SCHEMBL8133760 | 0.71 | HTR1A (0.33) | HTR2AABCC9 | |
| SCHEMBL8130466 | 0.70 | ABCC9 (0.41) | HTR2AKDM4EABCC9CYP2C9CYP1A2 | |
| SCHEMBL8123176 | 0.70 | GRM5 (0.39) | KDM4EMEN1KMT2A | |
| SCHEMBL8131499 | 0.69 | HTR2A (0.47) | HTR2AKDM4ECYP3A4KCNE1KCNQ1 | |
| SCHEMBL8897866 | 0.69 | PTGS1 (0.37) | PTGS2PTGDR2KDM4EXDHSLC22A12 |
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-0632033-B1 | NOVEL BENZOPYRAN DERIVATIVE | CHUGAI PHARMACEUTICAL CO LTD (JP) | 1999-04-07 | — | — | EP | disclosed |
| US-5646308-A | POTASSIUM CHANNEL ACTIVATORS USED AS ANTIASTHMATICS, ANTIEPILEPTICS | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 1997-07-08 | — | — | US | disclosed |
| EP-0632033-A1 | NOVEL BENZOPYRAN DERIVATIVE | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 1995-01-04 | — | — | EP | disclosed |