Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 6/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | CASP6 | P55212 | 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 | |
|---|---|---|---|---|
| SCHEMBL12964186 | 0.83 | MEN1 (0.55) | ALDH1A1MAPTTDP1TSHRMEN1 | |
| SCHEMBL18083002 | 0.82 | KMT2A (0.49) | ALDH1A1MAPTTDP1TSHRMEN1 | |
| SCHEMBL18083013 | 0.78 | ALDH1A1 (0.58) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| SCHEMBL27432919 | 0.76 | ALDH1A1 (0.48) | ALDH1A1TDP1TSHRMEN1KMT2A | |
| SCHEMBL18083010 | 0.75 | MEN1 (0.68) | ALDH1A1MAPTTDP1TSHRMEN1 | |
| SCHEMBL5707397 | 0.74 | MAPT (0.65) | ALDH1A1MAPTTDP1TSHRMEN1 | |
| SCHEMBL4427648 | 0.73 | ALDH1A1 (0.71) | ALDH1A1TDP1TSHRCYP3A4SMN1; SMN2 | |
| SCHEMBL10390684 | 0.71 | MEN1 (0.59) | ALDH1A1MAPTTDP1TSHRMEN1 | |
| SCHEMBL11202171 | 0.71 | MAPT (0.62) | ALDH1A1MAPTTDP1CYP3A4SMN1; SMN2 | |
| SCHEMBL1225832 | 0.70 | ALDH1A1 (1.00) | ALDH1A1MAPTTDP1TSHRMEN1 |
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-9434701-B2 | Aminoquinoxaline derivatives for treatment of neurodegenerative diseases | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) | 2016-09-06 | — | — | US | disclosed |