Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CCKBR | P32239 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | PRKACA | P17612 | 1/20 | 0.34 |
| ▸ | FRK | P42685 | 1/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | NEK4 | P51957 | 1/20 | 0.34 |
| ▸ | PRKCD | Q05655 | 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 | |
|---|---|---|---|---|
| SCHEMBL21452404 | 0.88 | MEN1 (0.42) | MEN1KMT2ACCKBREPHX2ALDH1A1 | |
| SCHEMBL21452126 | 0.82 | RORC (0.41) | CCR2 | |
| SCHEMBL21452370 | 0.82 | HDAC4 (0.47) | GPR119MEN1KMT2AOPRM1HDAC4 | |
| SCHEMBL23003282 | 0.82 | RORC (0.41) | CCR2 | |
| SCHEMBL23001555 | 0.81 | PDE2A (0.39) | HDAC4MAPTALDH1A1TDP1 | |
| SCHEMBL21452417 | 0.81 | PDE2A (0.39) | HDAC4MAPTALDH1A1TDP1 | |
| SCHEMBL21451897 | 0.79 | HDAC4 (0.39) | GPR119MEN1KMT2ACCKBRHCRTR1 | |
| SCHEMBL21452464 | 0.78 | DPP8 (0.35) | MEN1KMT2ABRD4CREBBPDDB1 | |
| SCHEMBL21452507 | 0.74 | SCN9A (0.35) | BRD4CREBBPEPHX2DDB1CRBN | |
| SCHEMBL21452508 | 0.74 | SCN9A (0.35) | BRD4CREBBPEPHX2DDB1CRBN |
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-2019192602-A1 | AROMATIC COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海键合医药科技有限公司 | 2019-10-10 | — | — | WO | disclosed |