Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | FLT1 | P17948 | 1/20 | 0.36 |
| ▸ | FLT4 | P35916 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | PNLIP | P16233 | 1/20 | 0.36 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.36 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL3571714 | 1.00 | ALDH1A1 (0.43) | ALDH1A1LMNAATMNPC1RAB9A | |
| SCHEMBL13504575 | 0.89 | GPR139 (0.47) | ALDH1A1LMNAATMNPC1RAB9A | |
| SCHEMBL3561695 | 0.89 | MEN1 (0.40) | ALDH1A1NPC1RAB9ASMN1; SMN2CES2 | |
| SCHEMBL13504606 | 0.89 | MEN1 (0.40) | ALDH1A1NPC1RAB9ASMN1; SMN2CES2 | |
| SCHEMBL3570586 | 0.89 | GPR139 (0.47) | ALDH1A1LMNAATMNPC1RAB9A | |
| SCHEMBL3570944 | 0.86 | NPC1 (0.44) | ALDH1A1NPC1RAB9ASMN1; SMN2CES2 | |
| SCHEMBL13504569 | 0.86 | NPC1 (0.44) | ALDH1A1NPC1RAB9ASMN1; SMN2CES2 | |
| SCHEMBL3566743 | 0.85 | HTT (0.45) | ALDH1A1LMNAATMNPC1RAB9A | |
| SCHEMBL3566739 | 0.85 | HTT (0.45) | ALDH1A1LMNAATMNPC1RAB9A | |
| SCHEMBL3566396 | 0.83 | ALDH1A1 (0.42) | ALDH1A1NPC1RAB9ASMN1; SMN2CES2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1742904-B1 | SUBSTITUTED ENAMINONES, THEIR DERIVATIVES AND USES THEREOF | UNIV CALIFORNIA (US) | 2012-10-31 | — | — | EP | claimed |