Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ASPH | Q12797 | 1/20 | 0.39 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.38 |
| ▸ | GSK3B | P49841 | 6/20 | 0.34 |
| ▸ | PRKCI | P41743 | 1/20 | 0.31 |
| ▸ | GNG2 | P59768 | 1/20 | 0.31 |
| ▸ | GNB1 | P62873 | 1/20 | 0.31 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.30 |
| ▸ | FEN1 | P39748 | 1/20 | 0.30 |
| ▸ | NOS3 | P29474 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 1/20 | 0.30 |
| ▸ | NOS2 | P35228 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6171233 | 0.81 | KDM4E (0.42) | KDM4EASPHKDM8GSK3BPRKCI | |
| SCHEMBL27554810 | 0.80 | GSK3B (0.38) | KDM4EPTPN1GSK3BPRKCIGNG2 | |
| Bromide SCHEMBL6169293 | 0.79 | GSK3B (0.37) | PTPN1GSK3BPRKCIGNG2GNB1 | |
| SCHEMBL6110659 | 0.76 | KDM4E (0.46) | KDM4EPTPN1GSK3BCYP1A2MAPT | |
| SCHEMBL22493360 | 0.73 | PTPN1 (0.36) | PTPN1GSK3BMAPT | |
| SCHEMBL30697148 | 0.72 | BRD4 (0.45) | KDM4ECYP1A2MAPT | |
| SCHEMBL4973075 | 0.72 | GSK3B (0.34) | PTPN1GSK3BPRKCI | |
| SCHEMBL26613698 | 0.71 | L3MBTL1 (0.42) | KDM4EASPHKDM8MAPTAOC3 | |
| SCHEMBL6170342 | 0.70 | GSK3B (0.41) | KDM4EASPHKDM8PTPN1GSK3B | |
| SCHEMBL29603588 | 0.70 | CTNNB1 (0.48) | KDM4EPTPN1GSK3BCYP1A2MAPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1045833-B1 | 2,3-SUBSTITUTED INDOLE COMPOUNDS AS COX-2 INHIBITORS | PFIZER (US) | 2005-11-02 | — | — | EP | disclosed |
| US-6608070-B1 | Useful for treatment of medical condition in which prostaglandins are implicated as pathogens | NAKAO KAZUNARI (JP) | 2003-08-19 | — | — | US | disclosed |
| EP-1045833-A1 | 2,3-SUBSTITUTED INDOLE COMPOUNDS AS COX-2 INHIBITORS | PFIZER INC. (US) | 2000-10-25 | — | — | EP | disclosed |
| WO-1999035130-A1 | 2,3-SUBSTITUTED INDOLE COMPOUNDS AS COX-2 INHIBITORS | PFIZER PHARMACEUTICALS INC. (JP) | 1999-07-15 | — | — | WO | disclosed |