Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 4/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | CHRNA10 | Q9GZZ6 | 1/20 | 0.36 |
| ▸ | CHRNA9 | Q9UGM1 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 5/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28050904 | 0.82 | NOTUM (0.49) | MPOKDM4EALDH1A1MAPK1NOTUM | |
| SCHEMBL28093362 | 0.80 | SMN1; SMN2 (0.41) | KDM4EALDH1A1 | |
| SCHEMBL28093432 | 0.75 | KDM4E (0.39) | KDM4EALDH1A1MAPK1 | |
| SCHEMBL7237526 | 0.74 | KDM4E (0.40) | MPOKDM4EALDH1A1MAPK1NOTUM | |
| SCHEMBL18725459 | 0.71 | CHRM1 (0.48) | MPOKDM4EALDH1A1MAPK1RORC | |
| SCHEMBL27803014 | 0.71 | KDM4E (0.44) | MPOKDM4EALDH1A1MAPK1NOTUM | |
| SCHEMBL11493922 | 0.70 | NOTUM (0.53) | MPOKDM4EALDH1A1MAPK1NOTUM | |
| SCHEMBL18756219 | 0.70 | MPO (0.45) | MPOKDM4EALDH1A1MAPK1NOTUM | |
| SCHEMBL41608 | 0.69 | NOTUM (0.59) | KDM4EALDH1A1MAPK1NOTUMDRD2 | |
| SCHEMBL18725387 | 0.69 | CHRM1 (0.49) | MPORORCCHRM1SCN9A |
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-105209453-A | Methylene linked quinolinyl modulators of ROR-gamma-T | JANSSEN PHARMACEUTICA NV | 2015-12-30 | — | — | CN | disclosed |