Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.42 |
| ▸ | CCR5 | P51681 | 2/20 | 0.42 |
| ▸ | CCR8 | P51685 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | EGFR | P00533 | 2/20 | 0.37 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.34 |
| ▸ | COPS5 | Q92905 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 2/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL18266948 | 0.80 | CCR1 (0.45) | CCR1CCR5CCR8SMN1; SMN2PSMD14 | |
| SCHEMBL9911108 | 0.78 | EGFR (0.42) | CCR1CCR5CCR8SMN1; SMN2EGFR | |
| SCHEMBL19044114 | 0.77 | CCR1 (0.42) | CCR1CCR5CCR8SMN1; SMN2PSMD14 | |
| SCHEMBL18256873 | 0.77 | NR4A2 (0.38) | CCR1SMN1; SMN2EGFRUSP2MAPT | |
| SCHEMBL1496382 | 0.74 | ALK (0.50) | CCR1CCR5CCR8SMN1; SMN2EGFR | |
| SCHEMBL30390607 | 0.74 | ALK (0.50) | CCR1CCR5CCR8SMN1; SMN2EGFR | |
| SCHEMBL20003731 | 0.73 | EGFR (0.35) | EGFR | |
| SCHEMBL21620457 | 0.73 | SMN1; SMN2 (0.46) | CCR1CCR5CCR8SMN1; SMN2PSMD14 | |
| SCHEMBL862238 | 0.73 | CCR1 (0.50) | CCR1CCR5CCR8SMN1; SMN2EGFR | |
| SCHEMBL10200833 | 0.71 | CCR1 (0.48) | CCR1CCR5CCR8SMN1; SMN2PSMD14 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3299369-A1 | PYRIDO-AZAHETERECYDIC COMPOUND AND PREPARATION METHOD AND USE THEREOF | Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) | 2018-03-28 | — | — | EP | disclosed |