Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | CA4 | P22748 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | CNR1 | P21554 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL25447154 | 0.93 | CNR1 (0.52) | CA2CA4LMNAPOLBTHRB | |
| SCHEMBL25447454 | 0.90 | CA2 (0.59) | CA2CA4LMNAPOLBTP53 | |
| SCHEMBL25447366 | 0.90 | CA2 (0.52) | CA2CA4LMNATP53CNR1 | |
| SCHEMBL25447034 | 0.88 | CA2 (0.50) | CA2CA4LMNAPOLBTHRB | |
| SCHEMBL25447283 | 0.87 | CA2 (0.48) | CA2CA4LMNATP53CNR1 | |
| SCHEMBL25447036 | 0.85 | KMT2A (0.51) | CA2CA4LMNATP53CNR1 | |
| SCHEMBL25447261 | 0.85 | MAPT (0.56) | CA2CA4LMNATP53NPC1 | |
| SCHEMBL25447001 | 0.84 | NPC1 (0.52) | CA2CA4POLBTP53ALDH1A1 | |
| SCHEMBL25447347 | 0.83 | HIF1A (0.47) | CA2CA4CNR1ALDH1A1NPC1 | |
| SCHEMBL25447260 | 0.83 | ALDH1A1 (0.50) | CA2CA4LMNATHRBTP53 |
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-2023078915-A1 | BIS(HETERO)ARYL THIOETHER (THIO)AMIDES AS FUNGICIDAL COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 2023-05-11 | — | — | WO | disclosed |