Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ANPEP | P15144 | 1/20 | 0.35 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | RAD52 | P43351 | 2/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | PADI1 | Q9ULC6 | 1/20 | 0.33 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3148550 | 0.82 | SIGMAR1 (0.42) | SMN1; SMN2CXCR4SIGMAR1 | |
| SCHEMBL1904293 | 0.82 | SMN1; SMN2 (0.41) | SMN1; SMN2POLBHSD17B10CXCR4CHRM5 | |
| SCHEMBL15314029 | 0.81 | MEN1 (0.44) | POLBHSD17B10MEN1KMT2AALDH1A1 | |
| SCHEMBL22320733 | 0.81 | SMN1; SMN2 (0.46) | SMN1; SMN2POLBHSD17B10CXCR4CHRM5 | |
| SCHEMBL9801548 | 0.81 | SMN1; SMN2 (0.46) | SMN1; SMN2POLBHSD17B10CXCR4CHRM5 | |
| SCHEMBL31510341 | 0.80 | GNAO1 (0.44) | CXCR4SIGMAR1 | |
| SCHEMBL28303412 | 0.80 | SMN1; SMN2 (0.39) | SMN1; SMN2POLBHSD17B10CXCR4CHRM5 | |
| Hydrochloric Acid SCHEMBL1904306 | 0.80 | SMN1; SMN2 (0.42) | SMN1; SMN2POLBHSD17B10CXCR4CHRM5 | |
| SCHEMBL24319375 | 0.79 | SMN1; SMN2 (0.58) | SMN1; SMN2POLBCHRM5CHRM3MEN1 | |
| SCHEMBL2800007 | 0.79 | SMN1; SMN2 (0.58) | SMN1; SMN2POLBCHRM5CHRM3MEN1 |
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-1497256-A1 | SUBSTITUTED 1,5-DIAMINOPENTAN-3-OL COMPOUNDS | Grünenthal GmbH (DE) | 2005-01-19 | — | — | EP | claimed |
| WO-2003051819-A1 | SUBSTITUTED 1,5-DIAMINOPENTAN-3-OL COMPOUNDS | Grünenthal GmbH (DE) | 2003-06-26 | — | — | WO | claimed |