Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.40 |
| ▸ | KLK1 | P06870 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.38 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.37 |
| ▸ | RORC | P51449 | 5/20 | 0.37 |
| ▸ | BTK | Q06187 | 1/20 | 0.36 |
| ▸ | CDC7 | O00311 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | CHUK | O15111 | 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 | |
|---|---|---|---|---|
| SCHEMBL27565523 | 0.73 | CYP11B1 (0.56) | HRH3MAPK1KDM4EALDH1A1NOTUM | |
| SCHEMBL28046310 | 0.73 | NCOA3 (0.56) | HRH3MAPK1KDM4EALDH1A1NOTUM | |
| SCHEMBL3353525 | 0.72 | EGFR (0.46) | HRH3MAPK1KDM4EALDH1A1NOTUM | |
| SCHEMBL6933468 | 0.72 | PDGFRB (0.53) | KDM4EALDH1A1 | |
| SCHEMBL22926854 | 0.72 | PDE10A (0.49) | KDM4EALDH1A1 | |
| SCHEMBL12277481 | 0.72 | HTT (0.41) | LMNAKDM4EALDH1A1 | |
| SCHEMBL12117421 | 0.70 | CHRM1 (0.46) | LMNADRD2DRD4DRD3MPO | |
| SCHEMBL3665773 | 0.69 | NOTUM (0.53) | LMNAHRH3DRD2DRD4DRD3 | |
| SCHEMBL6779647 | 0.67 | NOTUM (0.50) | LMNAHRH3DRD2DRD4DRD3 | |
| SCHEMBL7733429 | 0.66 | KDM4E (0.42) | KLKB1KDM4EALDH1A1 |
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-105829294-A | METHYLENE LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T | 詹森药业有限公司 | 2016-08-03 | — | — | CN | disclosed |