Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | TAS1R3 | Q7RTX0 | 3/20 | 0.48 |
| ▸ | TAS1R1 | Q7RTX1 | 3/20 | 0.48 |
| ▸ | ABL1 | P00519 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.42 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL18529866 | 0.89 | ABL1 (0.49) | ALDH1A1KDM4EHSD17B10ABL1TSHR | |
| SCHEMBL17063591 | 0.83 | ALDH1A1 (0.61) | ALDH1A1KDM4EHSD17B10TSHRLMNA | |
| SCHEMBL1976165 | 0.82 | ABL1 (0.44) | ALDH1A1KDM4EHSD17B10ABL1TSHR | |
| SCHEMBL31069548 | 0.82 | MEP1B (0.48) | ALDH1A1KDM4EHSD17B10TAS1R3TAS1R1 | |
| SCHEMBL523584 | 0.82 | ABL1 (0.57) | ALDH1A1KDM4EHSD17B10ABL1TSHR | |
| SCHEMBL30230209 | 0.80 | L3MBTL1 (0.42) | ALDH1A1KDM4EHSD17B10ABL1TSHR | |
| SCHEMBL7418272 | 0.79 | ABL1 (0.47) | ALDH1A1KDM4EHSD17B10ABL1TSHR | |
| SCHEMBL29800289 | 0.79 | PTGS2 (0.48) | ALDH1A1KDM4EHSD17B10ABL1TSHR | |
| SCHEMBL4243790 | 0.79 | PTGS2 (0.48) | ALDH1A1KDM4EHSD17B10ABL1TSHR | |
| SCHEMBL7467250 | 0.79 | ABL1 (0.47) | ALDH1A1KDM4EHSD17B10TAS1R3TAS1R1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1737831-A4 | NEUROLOGICALLY-ACTIVE COMPOUNDS | PRANA BIOTECHNOLOGY LTD (AU) | 2009-07-22 | — | — | EP | disclosed |
| EP-1737831-A1 | NEUROLOGICALLY-ACTIVE COMPOUNDS | Prana Biotechnology Limited (AU) | 2007-01-03 | — | — | EP | disclosed |
| WO-2005095360-A1 | NEUROLOGICALLY-ACTIVE COMPOUNDS | PRANA BIOTECHNOLOGY LIMITED (AU) | 2005-10-13 | — | — | WO | disclosed |