Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 1/20 | 0.45 |
| ▸ | CNR1 | P21554 | 3/20 | 0.38 |
| ▸ | CNR2 | P34972 | 3/20 | 0.38 |
| ▸ | KHK | P50053 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.35 |
| ▸ | EGLN2 | Q96KS0 | 3/20 | 0.35 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL21020966 | 0.79 | CYP3A4 (0.37) | RORCCNR1CNR2KHKCYP11B2 | |
| SCHEMBL14744157 | 0.78 | RORC (0.42) | RORCARADORA2AADORA1KDM4E | |
| SCHEMBL21116203 | 0.76 | USP8 (0.42) | CYP11B2TRPV4USP8USP7USP47 | |
| SCHEMBL22664353 | 0.74 | RORC (0.36) | RORCCNR1CNR2ARKDM4E | |
| SCHEMBL2650722 | 0.73 | KDM1A (0.43) | RORCKHKEGLN2ADORA2AADORA1 | |
| SCHEMBL1481701 | 0.73 | VCAM1 (0.48) | KHKCYP11B2KDM4EMEN1KMT2A | |
| SCHEMBL2651557 | 0.73 | BCAT1 (0.37) | RORCCYP11B2ADORA2AADORA1TRPV4 | |
| SCHEMBL2650000 | 0.72 | GABRA1 (0.42) | CYP11B2ADORA2AADORA1KDM4EMEN1 | |
| SCHEMBL2649762 | 0.71 | GRM5 (0.41) | ADORA2AADORA1KDM4EHPGD | |
| SCHEMBL24084181 | 0.71 | AR (0.39) | RORCCNR1CNR2CYP11B2AR |
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-2013029338-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2013-03-07 | — | — | WO | disclosed |