Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.55 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | ARG1 | P05089 | 1/20 | 0.41 |
| ▸ | ARG2 | P78540 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | FDPS | P14324 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.37 |
| ▸ | PTPRC | P08575 | 1/20 | 0.37 |
| ▸ | CETP | P11597 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11067231 | 1.00 | SMN1; SMN2 (0.55) | SMN1; SMN2HIF1ACES1SLC6A2TAAR1 | |
| SCHEMBL27889856 | 0.83 | SMN1; SMN2 (0.55) | SMN1; SMN2HIF1ASLC6A2TAAR1ARG1 | |
| SCHEMBL4595472 | 0.80 | SMN1; SMN2 (0.60) | SMN1; SMN2HIF1ASLC6A2TAAR1ARG1 | |
| SCHEMBL2032323 | 0.76 | SMN1; SMN2 (0.64) | SMN1; SMN2HIF1ACES1SLC6A2TAAR1 | |
| SCHEMBL1272429 | 0.76 | SMN1; SMN2 (0.64) | SMN1; SMN2HIF1ACES1SLC6A2TAAR1 | |
| SCHEMBL1272430 | 0.76 | SMN1; SMN2 (0.64) | SMN1; SMN2HIF1ACES1SLC6A2TAAR1 | |
| SCHEMBL1081531 | 0.75 | SMN1; SMN2 (0.69) | SMN1; SMN2HIF1ACES1SLC6A2TAAR1 | |
| Methane SCHEMBL28715292 | 0.74 | SMN1; SMN2 (0.62) | SMN1; SMN2HIF1ACES1SLC6A2TAAR1 | |
| SCHEMBL25433275 | 0.73 | SMN1; SMN2 (0.51) | SMN1; SMN2HIF1ASLC6A2TAAR1ARG1 | |
| SCHEMBL25435259 | 0.73 | SMN1; SMN2 (0.56) | SMN1; SMN2HIF1ASLC6A2TAAR1ARG1 |
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-0000034-B1 | FLUORINATED AMINES, COMPOSITIONS AND PROCESS FOR PREPARING SAID COMPOUNDS | MERCK & CO. INC. (US) | 1984-05-23 | — | — | EP | disclosed |