Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 3/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 7/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15510376 | 0.78 | CXCR4 (0.60) | CXCR4TAAR1HRH4CYP2D6TSHR | |
| SCHEMBL1205930 | 0.77 | CXCR4 (0.62) | CXCR4TAAR1HRH4CYP2D6TSHR | |
| SCHEMBL1638022 | 0.77 | TSHR (0.50) | CXCR4TAAR1CYP2D6TSHRLMNA | |
| SCHEMBL1637426 | 0.75 | CXCR4 (0.49) | CXCR4TAAR1 | |
| SCHEMBL1637986 | 0.75 | CXCR4 (0.39) | CXCR4TAAR1CYP2D6TSHRLMNA | |
| SCHEMBL1206163 | 0.75 | CXCR4 (0.58) | CXCR4TAAR1CYP2D6TSHRLMNA | |
| SCHEMBL1292672 | 0.74 | CXCR4 (0.49) | CXCR4TAAR1CYP2D6TSHRLMNA | |
| SCHEMBL1206644 | 0.74 | CXCR4 (0.47) | CXCR4TSHRLMNASMN1; SMN2ALDH1A1 | |
| SCHEMBL1205352 | 0.74 | CXCR4 (0.55) | CXCR4DRD2DRD4DRD3 | |
| SCHEMBL1637975 | 0.74 | CXCR4 (0.51) | CXCR4TAAR1CYP2D6TSHRLMNA |
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-1724263-B1 | BASIC AMINE COMPOUND AND USE THEREOF | KUREHA CORP (JP) | 2014-03-05 | — | — | EP | disclosed |