Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.65 |
| ▸ | MGAM | O43451 | 1/20 | 0.65 |
| ▸ | SI | P14410 | 1/20 | 0.65 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.65 |
| ▸ | PARP1 | P09874 | 7/20 | 0.52 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.48 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.48 |
| ▸ | PIM1 | P11309 | 1/20 | 0.48 |
| ▸ | CLK2 | P49760 | 1/20 | 0.48 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.48 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.48 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.48 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.48 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.48 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.48 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.48 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.48 |
| ▸ | MAP4K5 | Q9Y4K4 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29412040 | 0.82 | PARP1 (0.66) | GAAMGAMSIMGAM2PARP1 | |
| SCHEMBL3580402 | 0.82 | PARP1 (0.69) | GAAPARP1PRKD3MAP4K4PIM1 | |
| SCHEMBL3574922 | 0.80 | PARP1 (0.56) | PARP1PRKD3MAP4K4PIM1CLK2 | |
| SCHEMBL6948231 | 0.79 | PARP1 (0.69) | PARP1PRKD3MAP4K4PIM1CLK2 | |
| SCHEMBL6511414 | 0.79 | MGAM (1.00) | GAAMGAMSIMGAM2PKN1 | |
| SCHEMBL6170661 | 0.78 | PARP1 (0.64) | PARP1PRKD3MAP4K4PIM1CLK2 | |
| SCHEMBL7718410 | 0.77 | MGAM (0.69) | GAAMGAMSIMGAM2PARP1 | |
| SCHEMBL7259179 | 0.77 | ALDH1A1 (0.47) | GAAPARP1ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL28458039 | 0.76 | PKN1 (0.47) | GAAMGAMSIMGAM2PARP1 | |
| SCHEMBL9044494 | 0.76 | MGAM (0.71) | GAAMGAMSIMGAM2PARP1 |
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-2003057667-A2 | STRAPPED AND MODIFIED BIS (BENZIMIDAZOLE) DIAMIDES FOR ASYMMETRIC CATALYSTS AND OTHER APPLICATIONS | THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2003-07-17 | — | — | WO | disclosed |