Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.34 |
| ▸ | MLYCD | O95822 | 3/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.32 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | TAS2R14 | Q9NYV8 | 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 | |
|---|---|---|---|---|
| SCHEMBL28336781 | 0.82 | CA1 (0.46) | NPSR1HPGDMCOLN3ALDH1A1 | |
| SCHEMBL4667859 | 0.80 | TRPM8 (0.47) | NPSR1HPGDMLYCDALDH1A1SMN1; SMN2 | |
| SCHEMBL4000774 | 0.77 | KDM4E (0.47) | HPGDMLYCDALDH1A1 | |
| SCHEMBL19417942 | 0.73 | HPGD (0.41) | HPGDHDAC8MLYCDHDAC6HDAC1 | |
| SCHEMBL9923439 | 0.73 | ALDH1A1 (0.59) | HPGDHDAC6ALDH1A1SMN1; SMN2ACACB | |
| Water SCHEMBL27707253 | 0.71 | ALDH1A1 (0.57) | HPGDHDAC6ALDH1A1SMN1; SMN2ACACB | |
| SCHEMBL8581806 | 0.71 | TPMT (0.45) | NPSR1HPGDMCOLN3 | |
| SCHEMBL11857791 | 0.69 | HPGD (0.36) | NPSR1HPGDMCOLN3MLYCDALDH1A1 | |
| SCHEMBL24932160 | 0.69 | KDM4E (0.52) | HDAC8HDAC6HDAC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL471629 | 0.68 | HPGD (0.61) | HPGDMLYCDHDAC6HDAC1ALDH1A1 |
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-2925757-B1 | COMPOUNDS AND COMPOSITIONS FOR THE TREATMENT OF PARASITIC DISEASES | NOVARTIS AG (CH) | 2017-10-04 | — | — | EP | disclosed |