Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | F2R | P25116 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | UTS2R | Q9UKP6 | 2/20 | 0.36 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27367606 | 0.81 | GABRA1 (0.48) | GABRA1GABRB2TP53CLCN2TSHR | |
| SCHEMBL5934500 | 0.81 | GABRA1 (0.48) | GABRA1GABRB2TP53CLCN2TSHR | |
| SCHEMBL28213811 | 0.79 | GABRA1 (0.39) | GABRA1GABRB2CLCN2TSHRF2R | |
| SCHEMBL254888 | 0.79 | HSD17B1 (0.48) | GABRA1GABRB2TP53CLCN2TSHR | |
| Ammonia Solution, Strong SCHEMBL9019677 | 0.78 | ALDH1A1 (0.34) | TP53TSHRALDH1A1LMNAHPGD | |
| SCHEMBL2491928 | 0.78 | GABRA1 (0.50) | GABRA1GABRB2TP53CLCN2TSHR | |
| Hydrogen Peroxide SCHEMBL11781319 | 0.77 | CLCN2 (0.49) | GABRA1GABRB2CLCN2TSHRF2R | |
| SCHEMBL721894 | 0.77 | GABRA1 (0.44) | GABRA1GABRB2TP53CLCN2TSHR | |
| SCHEMBL815457 | 0.77 | GABRA1 (0.44) | GABRA1GABRB2TP53CLCN2TSHR | |
| SCHEMBL21319068 | 0.77 | GABRA1 (0.44) | GABRA1GABRB2TP53CLCN2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2812001-B1 | MODULATORS OF METHYL MODIFYING ENZYMES, COMPOSITIONS AND USES THEREOF | CONSTELLATION PHARMACEUTICALS INC (US) | 2017-06-14 | — | — | EP | disclosed |