Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGER4 | P35408 | 3/20 | 0.47 |
| ▸ | KDM4C | Q9H3R0 | 3/20 | 0.41 |
| ▸ | LIPC | P11150 | 1/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.39 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.36 |
| ▸ | VCP | P55072 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ASPH | Q12797 | 1/20 | 0.35 |
| ▸ | RIOX2 | Q8IUF8 | 1/20 | 0.35 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | CRHR1 | P34998 | 2/20 | 0.35 |
| ▸ | SCN5A | Q14524 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6165854 | 0.81 | PTGER4 (0.44) | PTGER4HDAC3HDAC1HDAC2 | |
| SCHEMBL6607350 | 0.80 | LIPC (0.47) | PTGER4KDM4CLIPCLIPGPIK3C3 | |
| SCHEMBL6641223 | 0.79 | L3MBTL1 (0.44) | PTGER4KDM4ENPC1RAB9A | |
| SCHEMBL27615952 | 0.76 | MEN1 (0.43) | KDM4CHDAC1KDM4ENPC1RAB9A | |
| SCHEMBL1726529 | 0.71 | PRKCI (0.41) | HDAC1KDM4ENPC1RAB9APOLB | |
| SCHEMBL27597105 | 0.71 | CD44 (0.52) | HDAC3HDAC1HDAC2KDM4ECYP3A4 | |
| SCHEMBL3930758 | 0.70 | PTGER4 (0.51) | PTGER4KDM4CLIPCLIPGKDM4E | |
| SCHEMBL15774700 | 0.70 | PTGER4 (0.67) | PTGER4KDM4CLIPCLIPGKDM4E | |
| SCHEMBL30102420 | 0.69 | PTGER4 (0.41) | PTGER4KDM4CKDM4EASPHRIOX2 | |
| SCHEMBL27270334 | 0.69 | PTGER4 (0.55) | PTGER4LIPCLIPGVCPCNR2 |
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-1379511-A1 | DIHYDRO-BENZO (b) (1, 4) DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS II | F. HOFFMANN-LA ROCHE AG (CH) | 2004-01-14 | — | — | EP | disclosed |
| WO-2002083652-A1 | DIHYDRO-BENZO [b] [1, 4] DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS II | F. HOFFMANN-LA ROCHE AG (CH) | 2002-10-24 | — | — | WO | disclosed |