Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | MEN1 | O00255 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | APAF1 | O14727 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | MPI | P34949 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TUBB1 | Q9H4B7 | 3/20 | 0.31 |
| ▸ | MGAM | O43451 | 1/20 | 0.31 |
| ▸ | SI | P14410 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL26318648 | 0.83 | NQO2 (0.38) | CA2CA4NQO2ALDH1A1MAPT | |
| SCHEMBL14405259 | 0.81 | ALDH1A1 (0.36) | ALDH1A1MAPTMEN1KMT2AGAA | |
| SCHEMBL1223611 | 0.80 | ALDH1A1 (0.44) | CA2CA4NQO2ALDH1A1MAPT | |
| SCHEMBL4922559 | 0.79 | CA2 (0.44) | CA2CA4NQO2ALDH1A1MAPT | |
| SCHEMBL7484583 | 0.77 | CA2 (0.48) | CA2CA4NQO2ALDH1A1MAPT | |
| SCHEMBL287639 | 0.77 | CA2 (0.38) | CA2CA4NQO2ALDH1A1MAPT | |
| SCHEMBL21567219 | 0.77 | L3MBTL1 (0.41) | ALDH1A1MAPTMEN1HPGDKMT2A | |
| SCHEMBL3836832 | 0.77 | ALOX5AP (0.35) | CA2CA4NQO2ALDH1A1MAPT | |
| SCHEMBL30407777 | 0.77 | ALOX5AP (0.38) | CA2CA4NQO2ALDH1A1MAPT | |
| SCHEMBL19629222 | 0.74 | HTR2A (0.35) | ALDH1A1MAPTGAAKDM4EMAPK1 |
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-2011002409-A1 | 5H-PYRROLO[3,4-£>]PYRAZIN-7-AMINE DERIVATIVES INHIBITORS OF BETA-SECRETASE | ASTRAZENECA AB (SE) | 2011-01-06 | — | — | WO | disclosed |