Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MGAM | O43451 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | PRNP | P04156 | 3/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | NCF1 | P14598 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 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 | |
|---|---|---|---|---|
| SCHEMBL9870690 | 0.76 | MGAM (0.48) | ALDH1A1HSD17B10GAAMAPTMGAM | |
| SCHEMBL4729157 | 0.74 | ALDH1A1 (0.46) | ALDH1A1HSD17B10GAAMAPTMGAM | |
| SCHEMBL5721000 | 0.73 | KDM4E (0.46) | ALDH1A1HSD17B10GAAMAPTMGAM | |
| SCHEMBL5720996 | 0.73 | KDM4E (0.46) | ALDH1A1HSD17B10GAAMAPTMGAM | |
| SCHEMBL29457163 | 0.72 | CYP1A2 (0.47) | ALDH1A1HSD17B10GAAMAPTMGAM | |
| SCHEMBL4064465 | 0.72 | ALDH1A1 (0.50) | ALDH1A1HSD17B10GAAMAPTMGAM | |
| SCHEMBL7462368 | 0.70 | IDO1 (0.53) | ALDH1A1CYP1A2LMNAKMT2A | |
| SCHEMBL10069400 | 0.69 | ALDH1A1 (0.48) | ALDH1A1HSD17B10GAAMAPTMGAM | |
| SCHEMBL29057277 | 0.69 | CYP1A2 (0.42) | ALDH1A1HSD17B10GAAMAPTMGAM | |
| SCHEMBL20746476 | 0.69 | NCF1 (0.43) | ALDH1A1HSD17B10MAPTMGAMCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1165500-A1 | AMIDE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES,TNF-ALPHA,AND AGGRECANASE | Du Pont Pharmaceuticals Company (US) | 2002-01-02 | — | — | EP | disclosed |
| WO-2000059874-A1 | NOVEL AMIDE DERIVATIVES AS INHIBITORS OF MATRIX METALLOPROTEINASES, TNF-α, AND AGGRECANASE | DU PONT PHARMACEUTICALS COMPANY (US) | 2000-10-12 | — | — | WO | disclosed |