Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | PELP1 | Q8IZL8 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Alcohol SCHEMBL7048031 | 0.97 | ALDH1A1 (0.40) | HCAR3ALDH1A1MAPTPTGER4RAB9A | |
| SCHEMBL29886944 | 0.86 | HCAR3 (0.55) | HCAR3PDK1LMNA | |
| SCHEMBL6892370 | 0.86 | HCAR3 (0.55) | HCAR3PDK1LMNA | |
| SCHEMBL13049970 | 0.81 | PDK1 (0.43) | HCAR3ALDH1A1MAPTRAB9APDK1 | |
| SCHEMBL29887339 | 0.81 | PDK1 (0.46) | HCAR3ALDH1A1MAPTRAB9APDK1 | |
| SCHEMBL2947165 | 0.81 | PDK1 (0.46) | HCAR3ALDH1A1MAPTRAB9APDK1 | |
| SCHEMBL2957417 | 0.80 | PDK1 (0.44) | HCAR3ALDH1A1MAPTRAB9APDK1 | |
| SCHEMBL6687315 | 0.80 | PDK1 (0.42) | HCAR3ALDH1A1MAPTRAB9APDK1 | |
| SCHEMBL6687317 | 0.80 | PDK1 (0.42) | HCAR3ALDH1A1MAPTRAB9APDK1 | |
| SCHEMBL6889362 | 0.79 | ALDH1A1 (0.39) | HCAR3ALDH1A1MAPTPTGER4RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004089529-A1 | METHOD FOR THE INTRAMOLECULAR ENERGY TRANSFER FOR THE CLEAVAGE OF LABILE FUNCTIONAL GROUP FROM BIOMOLECULES AND THE PROTECTED BIOMOLECULES | Universität Konstanz (DE) | 2004-10-21 | — | — | WO | disclosed |