Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.46 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.46 |
| ▸ | FAAH | O00519 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.45 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8575829 | 0.86 | KMT2A (0.63) | ALDH1A1MEN1LMNACYP1A2KMT2A | |
| SCHEMBL26079042 | 0.84 | CYP17A1 (0.50) | ALDH1A1CYP17A1MEN1LMNACYP1A2 | |
| SCHEMBL594716 | 0.83 | CYP17A1 (0.52) | ALDH1A1CYP17A1ADAMTS4FAAHPSMB8 | |
| SCHEMBL3616219 | 0.83 | MAPT (0.57) | ALDH1A1CYP17A1MEN1KMT2APTPN11 | |
| SCHEMBL3335259 | 0.83 | FAAH (0.62) | FAAH | |
| SCHEMBL13827429 | 0.83 | CYP17A1 (0.49) | ALDH1A1CYP17A1MEN1LMNACYP1A2 | |
| SCHEMBL13637520 | 0.83 | FAAH (0.62) | ALDH1A1FAAHRAB9AMAPT | |
| SCHEMBL13055402 | 0.83 | CYP17A1 (0.59) | ALDH1A1CYP17A1PTPN11SMN1; SMN2PSMB8 | |
| SCHEMBL22568331 | 0.82 | LMNA (0.51) | ALDH1A1CYP17A1MEN1LMNAKMT2A | |
| SCHEMBL22568324 | 0.82 | MEN1 (0.54) | ALDH1A1CYP17A1MEN1CYP1A2KMT2A |
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-2012021800-A2 | CASPASE INHIBITORS AS THERAPEUTICS FOR NEURAL AND ORGAN INJURY AND IMAGING | BANYAN BIOMARKERS (US) | 2012-02-16 | — | — | WO | disclosed |