Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | XDH | P47989 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.38 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CASP6 | P55212 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31439600 | 0.82 | PDK1 (0.58) | PDK1POLBALDH1A1SMN1; SMN2XDH | |
| SCHEMBL31439518 | 0.82 | PDE4B (0.42) | POLBALDH1A1SMN1; SMN2PDE4BLMNA | |
| SCHEMBL20033132 | 0.81 | CYP19A1 (0.58) | PDK1ALDH1A1SMN1; SMN2LMNAKDM4E | |
| SCHEMBL16924930 | 0.77 | PDK1 (0.66) | PDK1POLBALDH1A1SMN1; SMN2XDH | |
| SCHEMBL16924922 | 0.77 | PDK1 (0.70) | PDK1POLBALDH1A1SMN1; SMN2XDH | |
| SCHEMBL18232134 | 0.76 | PDK1 (0.56) | PDK1POLBALDH1A1SMN1; SMN2KMT2A | |
| SCHEMBL20033128 | 0.75 | PDK1 (0.55) | PDK1POLBALDH1A1SMN1; SMN2KMT2A | |
| Hydrochloric Acid SCHEMBL31439598 | 0.74 | PDK1 (0.54) | PDK1POLBALDH1A1XDHPDE4B | |
| SCHEMBL31439591 | 0.74 | PDK1 (0.62) | PDK1POLBALDH1A1SMN1; SMN2XDH | |
| SCHEMBL8800296 | 0.74 | PDK1 (0.72) | PDK1POLBALDH1A1SMN1; SMN2XDH |
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-2025015167-A2 | ERASTIN KETONE ANALOGS AND USES THEREOF | EXARTA THERAPEUTICS, INC. (US) | 2025-01-16 | — | — | WO | disclosed |