Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.37 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.36 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | DHODH | Q02127 | 2/20 | 0.35 |
| ▸ | CNR1 | P21554 | 2/20 | 0.34 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.34 |
| ▸ | MMP2 | P08253 | 2/20 | 0.34 |
| ▸ | MMP12 | P39900 | 2/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
| ▸ | GUCY1A1 | Q02108 | 1/20 | 0.34 |
| ▸ | GUCY1B1 | Q02153 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL3747145 | 0.83 | CD274 (0.38) | ADORA2AADORA1FYNDHODHCCNT1 | |
| SCHEMBL3763504 | 0.79 | AAK1 (0.39) | ADORA2AADORA1FYNDHODHAAK1 | |
| SCHEMBL8218291 | 0.78 | TRPV3 (0.46) | TRPV3GUCY1A1GUCY1B1KCNH2 | |
| SCHEMBL8214930 | 0.72 | DHODH (0.40) | TRPV3ADORA2AADORA1DHODH | |
| SCHEMBL3749641 | 0.71 | DHODH (0.45) | ADORA2AADORA1DHODHCCNT1CDK9 | |
| SCHEMBL23943222 | 0.67 | CD274 (0.46) | PLA2G2AADORA2AADORA1FYNDHODH | |
| SCHEMBL8214581 | 0.67 | ERN1 (0.33) | TRPV3 | |
| SCHEMBL23925778 | 0.67 | CD274 (0.46) | ADORA2AADORA1FYNDHODHCCNT1 | |
| SCHEMBL3757598 | 0.67 | ADORA2A (0.39) | ADORA2AADORA1FYNDHODHGPBAR1 | |
| SCHEMBL3755649 | 0.66 | DHODH (0.47) | ADORA2AADORA1DHODH |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008031501-A2 | 2-PHENOXY NICOTINE ACID DERIVATIVE AND USE THEREOF | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2008-03-20 | — | — | WO | disclosed |