Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.68 |
| ▸ | EGLN2 | Q96KS0 | 2/20 | 0.59 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.42 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.42 |
| ▸ | KDR | P35968 | 2/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.42 |
| ▸ | CSF1R | P07333 | 1/20 | 0.42 |
| ▸ | PRKACA | P17612 | 1/20 | 0.42 |
| ▸ | CDK8 | P49336 | 1/20 | 0.42 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.42 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.42 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9870207 | 0.77 | KDM4E (0.49) | BACE1EGLN2GAAKDM4EALDH1A1 | |
| SCHEMBL9869668 | 0.74 | EGLN2 (1.00) | BACE1EGLN2GAAKDM4EALDH1A1 | |
| SCHEMBL11010979 | 0.73 | SMN1; SMN2 (0.58) | BACE1EGLN2GAAKDM4EALDH1A1 | |
| SCHEMBL14920062 | 0.72 | EGLN2 (0.68) | BACE1EGLN2IDO1MAP2K1PIM1 | |
| SCHEMBL5462584 | 0.72 | KDM4E (0.70) | BACE1EGLN2GAAKDM4EALDH1A1 | |
| SCHEMBL11009860 | 0.72 | BACE1 (0.62) | BACE1EGLN2GAAALDH1A1SMN1; SMN2 | |
| SCHEMBL10474240 | 0.71 | IKBKB (0.44) | BACE1GAAKDM4EIDO1DYRK1A | |
| Hydrochloric Acid SCHEMBL11014780 | 0.70 | BACE1 (0.61) | BACE1EGLN2GAAALDH1A1SMN1; SMN2 | |
| SCHEMBL9869834 | 0.69 | IDO1 (0.54) | BACE1EGLN2GAAKDM4EALDH1A1 | |
| SCHEMBL5408046 | 0.69 | BACE1 (0.53) | BACE1EGLN2KDM4EALDH1A1SMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5037980-A | Anxiolytic agents, hypotensive agents | AMERICAN CYANAMID COMPANY (US) | 1991-08-06 | — | — | US | claimed |
| US-5037980-A | Anxiolytic agents, hypotensive agents | AMERICAN CYANAMID COMPANY (US) | 1991-08-06 | — | — | US | disclosed |