Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GHSR | Q92847 | 6/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14103533 | 0.98 | CXCR4 (0.66) | CXCR4ALDH1A1KDM4ELMNAPOLB | |
| SCHEMBL14103214 | 0.97 | CXCR4 (0.70) | CXCR4ALDH1A1KDM4ELMNAPOLB | |
| SCHEMBL14102756 | 0.96 | CXCR4 (0.64) | CXCR4ALDH1A1KDM4ELMNAPOLB | |
| SCHEMBL2695171 | 0.92 | CXCR4 (0.71) | CXCR4ALDH1A1KDM4ELMNAPOLB | |
| SCHEMBL2694083 | 0.92 | CXCR4 (0.71) | CXCR4ALDH1A1KDM4ELMNAPOLB | |
| SCHEMBL14103215 | 0.90 | CXCR4 (0.62) | CXCR4ALDH1A1KDM4ELMNAPOLB | |
| SCHEMBL2693825 | 0.89 | CXCR4 (0.72) | CXCR4ALDH1A1KDM4ELMNAPOLB | |
| SCHEMBL2696885 | 0.88 | CXCR4 (0.76) | CXCR4ALDH1A1KDM4ELMNAPOLB | |
| SCHEMBL2693480 | 0.88 | CXCR4 (0.76) | CXCR4ALDH1A1KDM4ELMNAPOLB | |
| SCHEMBL2692247 | 0.87 | CXCR4 (0.69) | CXCR4ALDH1A1KDM4ELMNAPOLB |
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-1961744-A1 | BASIC GROUP-CONTAINING COMPOUND AND USE THEREOF | ONO PHARMACEUTICAL CO., LTD. (JP) | 2008-08-27 | — | — | EP | disclosed |