Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 5/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.34 |
| ▸ | RAD52 | P43351 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | CCR2 | P41597 | 1/20 | 0.31 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL5892042 | 1.00 | CXCR4 (0.40) | CXCR4POLBSMN1; SMN2SIGMAR1RAD52 | |
| SCHEMBL8658731 | 0.87 | CXCR4 (0.50) | CXCR4POLBSMN1; SMN2SIGMAR1RAD52 | |
| SCHEMBL6282596 | 0.84 | — | — | |
| SCHEMBL9191635 | 0.79 | CXCR4 (0.68) | CXCR4SMN1; SMN2SIGMAR1HRH3MEN1 | |
| SCHEMBL24684844 | 0.78 | HTR1A (0.43) | CXCR4SIGMAR1RAD52CHRM5CHRM3 | |
| SCHEMBL15558472 | 0.78 | HTR1A (0.43) | CXCR4SIGMAR1RAD52CHRM5CHRM3 | |
| SCHEMBL7840193 | 0.77 | ADRA2C (0.48) | CHRM5HRH3MEN1ADRA2CKMT2A | |
| SCHEMBL5892038 | 0.76 | CXCR4 (0.41) | CXCR4HRH3 | |
| SCHEMBL2578794 | 0.75 | POLB (0.37) | CXCR4POLBSMN1; SMN2SIGMAR1RAD52 | |
| SCHEMBL27980711 | 0.73 | CXCR4 (0.36) | CXCR4POLBSMN1; SMN2SIGMAR1RAD52 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0952842-A2 | A METHOD OF TREATING CANCER | Merck & Co., Inc. (US) | 1999-11-03 | — | — | EP | disclosed |
| WO-1997038664-A2 | A METHOD OF TREATING CANCER | MERCK & CO., INC. (US) | 1997-10-23 | — | — | WO | disclosed |