Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 11/20 | 0.74 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.52 |
| ▸ | CCR2 | P41597 | 1/20 | 0.52 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | RAD52 | P43351 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | HRH2 | P25021 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5573157 | 1.00 | CXCR4 (0.74) | CXCR4HRH3MEN1CHRM2CHRM1 | |
| Hydrochloric Acid SCHEMBL5569544 | 0.97 | CXCR4 (0.71) | CXCR4HRH3MEN1CHRM2CHRM1 | |
| SCHEMBL674657 | 0.95 | CXCR4 (0.83) | CXCR4HRH3MEN1CHRM2CHRM1 | |
| SCHEMBL13661067 | 0.95 | CXCR4 (0.68) | CXCR4HRH3MEN1CHRM2CHRM1 | |
| SCHEMBL946201 | 0.92 | CXCR4 (0.62) | CXCR4HRH3MEN1CHRM2CHRM1 | |
| SCHEMBL12992865 | 0.92 | CXCR4 (0.62) | CXCR4HRH3MEN1CHRM2CHRM1 | |
| SCHEMBL5569626 | 0.90 | CXCR4 (0.91) | CXCR4HRH3MEN1CHRM2CHRM1 | |
| Hydrochloric Acid SCHEMBL3068935 | 0.89 | CXCR4 (0.60) | CXCR4HRH3MEN1CHRM2CHRM1 | |
| SCHEMBL6913246 | 0.89 | CXCR4 (0.60) | CXCR4HRH3MEN1CHRM2CHRM1 | |
| SCHEMBL28078047 | 0.89 | CXCR4 (0.60) | CXCR4HRH3MEN1CHRM2CHRM1 |
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-3596039-B1 | PROCESS FOR MANUFACTURING CHAIN-EXTENDED HYDROXYETHYLETHYLENEAMINES, ETHYLENEAMINES, OR MIXTURES THEREOF | NOURYON CHEMICALS INT BV (NL) | 2021-05-05 | — | — | EP | disclosed |