Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 2/20 | 0.46 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.42 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.42 |
| ▸ | FPR2 | P25090 | 4/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.38 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29779454 | 1.00 | RORC (0.46) | RORCNR1H2NR1H3FPR2PDE5A | |
| SCHEMBL27528621 | 1.00 | RORC (0.46) | RORCNR1H2NR1H3FPR2PDE5A | |
| SCHEMBL22039428 | 0.87 | HTR7 (0.42) | RORCL3MBTL1DDB1CRBNPRKCZ | |
| SCHEMBL7236411 | 0.87 | HTR7 (0.42) | RORCL3MBTL1DDB1CRBNPRKCZ | |
| SCHEMBL7589379 | 0.86 | L3MBTL1 (0.51) | RORCNR1H2NR1H3L3MBTL1 | |
| SCHEMBL3496027 | 0.84 | GPR119 (0.47) | L3MBTL1 | |
| SCHEMBL7233985 | 0.84 | KDM1A (0.46) | L3MBTL1DDB1CRBNELANE | |
| SCHEMBL5620456 | 0.83 | LIPE (0.47) | PDE5AL3MBTL1 | |
| SCHEMBL6832962 | 0.81 | GPR119 (0.49) | — | |
| SCHEMBL7043305 | 0.80 | DRD2 (0.40) | RORCNR1H2NR1H3L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114716370-A | Pyridine-containing polycyclic derivative inhibitor, and preparation method and application thereof | 上海翰森生物医药科技有限公司 | 2022-07-08 | — | — | CN | disclosed |