Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | THPO | P40225 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 7/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | GMNN | O75496 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3669352 | 0.83 | PDE2A (0.41) | MAPK1NPSR1PTGDRFAAHCTNNB1 | |
| SCHEMBL8367478 | 0.81 | CNR1 (0.40) | ALOX15NPSR1PTGDRFAAHCTNNB1 | |
| SCHEMBL22657573 | 0.79 | CTNNB1 (0.41) | NPSR1PTGDRFAAHCTNNB1WNT3A | |
| SCHEMBL27044834 | 0.78 | SKP2 (0.42) | MAPK1HSD17B10NPSR1ALDH1A1HPGD | |
| SCHEMBL1971747 | 0.77 | TAAR1 (0.53) | MAPTTP53ALOX15MAPK1THPO | |
| SCHEMBL22657669 | 0.77 | CTNNB1 (0.43) | MAPTKDM4EALDH1A1PTGDRFAAH | |
| SCHEMBL23023195 | 0.77 | GAA (0.51) | MAPTKDM4EALDH1A1POLBSIGMAR1 | |
| SCHEMBL2663369 | 0.77 | CTNNB1 (0.41) | ALOX15NPSR1FAAHCTNNB1WNT3A | |
| SCHEMBL1967416 | 0.76 | SMYD3 (0.41) | SMN1; SMN2PTGDRCHRM2CHRM1FAAH | |
| SCHEMBL80920 | 0.76 | FAAH (0.40) | PTGDRFAAHCTNNB1WNT3A |
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-2021011778-A1 | SMALL MOLECULE INHIBITORS OF KU70/80 AND USES THEREOF | ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) | 2021-01-21 | — | — | WO | disclosed |