Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.42 |
| ▸ | USP2 | O75604 | 4/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.41 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7087140 | 0.85 | ALDH1A1 (0.42) | ALDH1A1MAPTMEN1KMT2ACYP2D6 | |
| SCHEMBL7083930 | 0.81 | ALDH1A1 (0.51) | ALDH1A1MAPTMEN1KMT2ACYP2D6 | |
| SCHEMBL7089649 | 0.79 | PGR (0.43) | MAPTCYP2D6HIF1ACYP3A4CYP1A2 | |
| SCHEMBL7137822 | 0.76 | CYP2D6 (0.41) | ALDH1A1CYP2D6HSD17B10HIF1ACYP3A4 | |
| SCHEMBL6989644 | 0.71 | ALDH1A1 (0.51) | ALDH1A1MAPTMEN1KMT2ACYP2D6 | |
| SCHEMBL6991506 | 0.71 | MAPT (0.50) | MAPTGAAHTTLMNAMAPK1 | |
| SCHEMBL6991463 | 0.70 | TSHR (0.51) | ALDH1A1MAPTMEN1KMT2ACYP2D6 | |
| SCHEMBL7076644 | 0.68 | HIF1A (0.48) | ALDH1A1MAPTMEN1KMT2ACYP2D6 | |
| SCHEMBL7081753 | 0.68 | LMNA (0.52) | ALDH1A1MAPTMEN1KMT2ACYP2D6 | |
| SCHEMBL30606801 | 0.67 | MAPT (0.87) | ALDH1A1MAPTMEN1KMT2AHSD17B10 |
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-1303482-A2 | N-SUBSTITUTED-1-AMINO-1,1-DIALKYLCARBOXYLIC ACID DERIVATIVES | MERCK PATENT GmbH (DE) | 2003-04-23 | — | — | EP | disclosed |
| WO-2002008177-A2 | N-SUBSTITUTED-1-AMINO-1,1-DIALKYLCARBOXYLIC ACID DERIVATIVES | MERCK PATENT GMBH (DE) | 2002-01-31 | — | — | WO | disclosed |