Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 13/20 | 0.40 |
| ▸ | DPP4 | P27487 | 3/20 | 0.39 |
| ▸ | DPP7 | Q9UHL4 | 3/20 | 0.39 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.39 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3080101 | 0.87 | ALDH1A1 (0.42) | ALDH1A1TDP1DPP4DPP7DPP8 | |
| SCHEMBL3076465 | 0.87 | ALDH1A1 (0.42) | ALDH1A1TDP1DPP4DPP7DPP8 | |
| SCHEMBL581683 | 0.87 | ALDH1A1 (0.42) | ALDH1A1TDP1DPP4DPP7DPP8 | |
| SCHEMBL3075396 | 0.80 | ALDH1A1 (0.49) | ALDH1A1TDP1KDM4EMEN1KMT2A | |
| SCHEMBL581488 | 0.80 | ALDH1A1 (0.49) | ALDH1A1TDP1KDM4EMEN1KMT2A | |
| SCHEMBL3081361 | 0.80 | ALDH1A1 (0.49) | ALDH1A1TDP1KDM4EMEN1KMT2A | |
| SCHEMBL582364 | 0.80 | HTR2A (0.41) | ALDH1A1MEN1KMT2A | |
| SCHEMBL582160 | 0.77 | KMT2A (0.41) | ALDH1A1TDP1KDM4EMEN1KMT2A | |
| SCHEMBL581942 | 0.76 | KMT2A (0.37) | ALDH1A1CHRM3KDM4EMEN1KMT2A | |
| SCHEMBL581773 | 0.75 | ALDH1A1 (0.43) | ALDH1A1TDP1KDM4EMEN1KMT2A |
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 |