Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 5/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CRHBP | P24387 | 3/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | KDM6B | O15054 | 1/20 | 0.40 |
| ▸ | KDM5C | P41229 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.40 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.40 |
| ▸ | PRKDC | P78527 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | ATR | Q13535 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL2710667 | 0.93 | PRKDC (0.39) | CTSAADORA2AADORA1KDM4EALDH1A1 | |
| SCHEMBL2709818 | 0.86 | ADORA2A (0.39) | CTSAADORA2AADORA1KDM4EALDH1A1 | |
| SCHEMBL2710671 | 0.83 | ADORA2A (0.37) | CTSAADORA2AADORA1KDM4EALDH1A1 | |
| SCHEMBL6468264 | 0.82 | MAPT (0.42) | ADORA2AADORA1KDM4EALDH1A1HPGD | |
| SCHEMBL2343635 | 0.77 | TSHR (0.44) | CTSAKDM4EALDH1A1CRHBPCRHR2 | |
| SCHEMBL3590080 | 0.73 | GAA (0.60) | SMN1; SMN2NPC1MAPTRAB9AGAA | |
| SCHEMBL21144538 | 0.73 | TSHR (0.61) | KDM4EALDH1A1KDM6BKDM5CKDM4C | |
| SCHEMBL23381741 | 0.72 | HTT (0.49) | ADORA2AKDM4EALDH1A1CRHBPCRHR2 | |
| SCHEMBL2070250 | 0.72 | TGFBR1 (0.49) | KDM4EALDH1A1CRHBPCRHR2PRKDC | |
| SCHEMBL3596754 | 0.72 | ACHE (0.64) | KDM4EALDH1A1CRHBPCRHR2HPGD |
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-2012054510-A1 | OXADIAZOLE COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF | COMENTIS, INC. (US) | 2012-04-26 | — | — | WO | disclosed |