Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | AXL | P30530 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CYP46A1 | Q9Y6A2 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 1/20 | 0.35 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.35 |
| ▸ | GCK | P35557 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3345812 | 0.83 | PIM1 (0.43) | ALDH1A1KDM4EGLAGAAAXL | |
| SCHEMBL3350903 | 0.81 | ABL1 (0.37) | ALDH1A1KDM4EGLAGAATDP1 | |
| SCHEMBL3344570 | 0.77 | RORC (0.41) | ALDH1A1KDM4EGLAGAAAXL | |
| SCHEMBL3373097 | 0.76 | TBXAS1 (0.47) | ALDH1A1KDM4EKMT2A | |
| SCHEMBL3348530 | 0.76 | DGAT1 (0.40) | ALDH1A1KDM4EGLAGAAAXL | |
| SCHEMBL3448577 | 0.72 | TSHR (0.44) | ALDH1A1TDP1L3MBTL1HSD17B10KMT2A | |
| SCHEMBL19261271 | 0.70 | GAA (0.40) | ALDH1A1KDM4EGLAGAACYP46A1 | |
| SCHEMBL3346064 | 0.69 | PIM1 (0.51) | KMT2ASLC2A1GCKPIM1PIM2 | |
| SCHEMBL30601109 | 0.69 | CYP11B1 (0.48) | ALDH1A1KDM4EGLAGAAL3MBTL1 | |
| SCHEMBL29042069 | 0.69 | TSHR (0.42) | ALDH1A1KDM4EGLAGAAHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010038081-A2 | HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF | ASTRAZENECA AB (SE) | 2010-04-08 | — | — | WO | disclosed |