Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | GAA | P10253 | 1/20 | 0.63 |
| ▸ | MAPT | P10636 | 1/20 | 0.63 |
| ▸ | CHRM2 | P08172 | 12/20 | 0.58 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.58 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.58 |
| ▸ | BCHE | P06276 | 4/20 | 0.58 |
| ▸ | ACHE | P22303 | 4/20 | 0.58 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.58 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.58 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.58 |
| ▸ | CHRM3 | P20309 | 4/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | THPO | P40225 | 1/20 | 0.58 |
| ▸ | RECQL | P46063 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL5695121 | 0.83 | ALDH1A1 (0.79) | ALDH1A1GAAMAPTCHRM2GRIN1 | |
| SCHEMBL16421756 | 0.81 | HTR2A (0.51) | ALDH1A1GAAMAPTCHRM2GRIN1 | |
| SCHEMBL22838152 | 0.81 | ALDH1A1 (0.66) | ALDH1A1GAAMAPTCHRM2GRIN1 | |
| SCHEMBL418619 | 0.81 | ALDH1A1 (0.66) | ALDH1A1GAAMAPTCHRM2GRIN1 | |
| SCHEMBL1521207 | 0.80 | ALDH1A1 (0.63) | ALDH1A1GAAMAPTKDM4ECYP2D6 | |
| SCHEMBL4918396 | 0.79 | CHRM2 (0.79) | ALDH1A1MAPTCHRM2GRIN1GRIN2A | |
| SCHEMBL19091168 | 0.79 | ALDH1A1 (0.63) | ALDH1A1GAAMAPTCHRM2GRIN1 | |
| Hydrochloric Acid SCHEMBL7876474 | 0.79 | MAPT (0.69) | ALDH1A1GAAMAPTCHRM2GRIN1 | |
| SCHEMBL4573475 | 0.79 | ALDH1A1 (0.63) | ALDH1A1GAAMAPTCHRM2GRIN1 | |
| SCHEMBL27582570 | 0.79 | ALDH1A1 (0.63) | ALDH1A1GAAMAPTCHRM2GRIN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6329373-B1 | AMIDES WITH HYDROXYAMIDES AS ENZYME INHIBITORS | BRITISH BIOTECH PHARMACEUTICALS, LTD. (GB) | 2001-12-11 | — | — | US | disclosed |