Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.39 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.39 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.38 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.38 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL581795 | 1.00 | ALDH1A1 (0.47) | ALDH1A1KCNN4NOTUMKMT2ALMNA | |
| SCHEMBL3073129 | 0.96 | ALDH1A1 (0.49) | ALDH1A1KCNN4KMT2ALMNAUSP2 | |
| SCHEMBL580798 | 0.96 | ALDH1A1 (0.49) | ALDH1A1KCNN4KMT2ALMNAUSP2 | |
| SCHEMBL3062815 | 0.96 | ALDH1A1 (0.49) | ALDH1A1KCNN4KMT2ALMNAUSP2 | |
| SCHEMBL587487 | 0.92 | ALDH1A1 (0.38) | ALDH1A1KCNN4KMT2ATRPV4MEN1 | |
| SCHEMBL581727 | 0.89 | NOTUM (0.38) | ALDH1A1NOTUMMAPK1POLBSMN1; SMN2 | |
| SCHEMBL581726 | 0.89 | NOTUM (0.38) | ALDH1A1NOTUMMAPK1POLBSMN1; SMN2 | |
| SCHEMBL580827 | 0.89 | NOTUM (0.48) | ALDH1A1NOTUMKMT2ALMNAUSP2 | |
| SCHEMBL580911 | 0.89 | TACR1 (0.40) | ALDH1A1NOTUMLMNAUSP2MAPK1 | |
| SCHEMBL581242 | 0.88 | ALDH1A1 (0.40) | ALDH1A1KCNN4KMT2ATRPV4MEN1 |
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-2417131-A1 | ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS | AstraZeneca AB (SE) | 2012-02-15 | — | — | EP | disclosed |
| WO-2010117323-A1 | METHOD AND APPARATUS FOR PRODUCING HEAT ENERGY AND CARBON DIOXIDE | ASTRAZENECA AB (SE) | 2010-10-14 | — | — | WO | disclosed |