Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6550733 | 1.00 | NFE2L2 (0.40) | NFE2L2ABCG2ADRB2ADRB1ADRB3 | |
| Hydrochloric Acid SCHEMBL6549870 | 0.83 | ADRB2 (0.36) | NFE2L2ABCG2ADRB2ADRB1ADRB3 | |
| SCHEMBL6550497 | 0.77 | POLB (0.45) | ABCG2KDM4EALDH1A1HPGDNPC1 | |
| SCHEMBL6550490 | 0.77 | POLB (0.45) | ABCG2KDM4EALDH1A1HPGDNPC1 | |
| SCHEMBL26046337 | 0.76 | ABCG2 (0.51) | NFE2L2ABCG2KDM4EALDH1A1HPGD | |
| SCHEMBL7673620 | 0.75 | ALDH1A1 (0.47) | KDM4EALDH1A1HPGDGAASMN1; SMN2 | |
| SCHEMBL7673613 | 0.75 | ALDH1A1 (0.47) | KDM4EALDH1A1HPGDGAASMN1; SMN2 | |
| SCHEMBL6550965 | 0.73 | ADRB2 (0.47) | ADRB2ADRB1ADRB3CA1CA2 | |
| SCHEMBL6550971 | 0.73 | ADRB2 (0.47) | ADRB2ADRB1ADRB3CA1CA2 | |
| SCHEMBL3976762 | 0.72 | CA1 (0.41) | KDM4EALDH1A1HPGDHSD17B10HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| US-6500823-B1 | ENERGY DEFICIENCY OF THE CELL CAUSED BY PARP INHIBITION, IN DIABETES COMPLICATIONS, IN OXYGEN DEFICIENT STATUS OF THE HEART AND BRAIN, IN NEURODEGENERATIVE DISEASES, IN THE TREATMENT OF AUTOIMMUNE AND/OR VIRAL DISEASES | N-GENE RESEARCH LABORATORIES, INC. | 2002-12-31 | — | — | US | claimed |
| EP-1115697-B1 | UNSATURATED HYDROXIMIC ACID DERIVATIVES AS PARP INHIBITORS | GENE KUTATO KFT N (HU) | 2004-02-04 | — | — | EP | disclosed |