Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 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 | |
|---|---|---|---|---|
| SCHEMBL1073582 | 0.85 | MAPT (0.43) | ALDH1A1CYP3A4HTTGAASMN1; SMN2 | |
| SCHEMBL16832720 | 0.83 | ALDH1A1 (0.66) | ALDH1A1CYP3A4HTTGAASMN1; SMN2 | |
| SCHEMBL1074332 | 0.81 | ALDH1A1 (0.37) | ALDH1A1CYP3A4HTTSMN1; SMN2POLB | |
| SCHEMBL13626342 | 0.81 | CYP3A4 (0.54) | ALDH1A1CYP3A4HTTGAASMN1; SMN2 | |
| SCHEMBL5769460 | 0.81 | GAA (0.57) | ALDH1A1CYP3A4HTTGAASMN1; SMN2 | |
| SCHEMBL14124983 | 0.78 | ALDH1A1 (0.50) | ALDH1A1CYP3A4HTTGAASMN1; SMN2 | |
| SCHEMBL14124979 | 0.78 | ALDH1A1 (0.53) | ALDH1A1CYP3A4HTTGAASMN1; SMN2 | |
| SCHEMBL14124978 | 0.74 | MAPK1 (0.57) | ALDH1A1CYP3A4HTTGAASMN1; SMN2 | |
| SCHEMBL16832303 | 0.73 | SMN1; SMN2 (0.58) | ALDH1A1CYP3A4GAASMN1; SMN2POLB | |
| SCHEMBL14124974 | 0.72 | ALDH1A1 (0.49) | ALDH1A1CYP3A4HTTGAASMN1; SMN2 |
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-2009140451-A1 | KERATIN DYEING COMPOUNDS, KERATIN DYEING COMPOSITIONS CONTAINING SAID COMPOUNDS, AND USE THEREOF | THE PROCTER & GAMBLE COMPANY (US) | 2009-11-19 | — | — | WO | disclosed |