Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 3/20 | 0.46 |
| ▸ | ESRRG | P62508 | 3/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.45 |
| ▸ | CACNB4 | O00305 | 2/20 | 0.44 |
| ▸ | CACNA1A | O00555 | 2/20 | 0.44 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.44 |
| ▸ | CACNG3 | O60359 | 2/20 | 0.44 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.44 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.44 |
| ▸ | CACNB3 | P54284 | 2/20 | 0.44 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.44 |
| ▸ | CACNG7 | P62955 | 2/20 | 0.44 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.44 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.44 |
| ▸ | CACNB1 | Q02641 | 2/20 | 0.44 |
| ▸ | CACNG1 | Q06432 | 2/20 | 0.44 |
| ▸ | CACNB2 | Q08289 | 2/20 | 0.44 |
| ▸ | CACNA1S | Q13698 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31337255 | 0.91 | KCNH2 (0.57) | KCNH2SCN5AESRRGCACNB4CACNA1A | |
| SCHEMBL31337246 | 0.91 | KCNH2 (0.66) | KCNH2SCN5AACKR3TOP2AKDM1A | |
| SCHEMBL31337402 | 0.88 | KCNH2 (0.62) | KCNH2SCN5AESR1ESRRGESR2 | |
| SCHEMBL31337224 | 0.86 | ESRRG (0.55) | KCNH2ESR1ESRRGESR2STS | |
| SCHEMBL31337223 | 0.82 | KCNH2 (0.80) | KCNH2SCN5AESR1ESRRGESR2 | |
| SCHEMBL31337437 | 0.79 | KCNH2 (0.74) | KCNH2SCN5AESRRGPRSS12CHRNA7 | |
| SCHEMBL31337231 | 0.79 | PRSS12 (0.54) | KCNH2ESR1ESRRGESR2CACNB4 | |
| SCHEMBL31337265 | 0.79 | KCNH2 (0.65) | KCNH2SCN5AESR1ESRRGPRSS12 | |
| SCHEMBL31337250 | 0.76 | KCNH2 (0.61) | KCNH2SCN5ACHRNA7 | |
| SCHEMBL31337263 | 0.75 | ESRRG (0.59) | KCNH2ESR1ESRRGESR2PRSS12 |
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-2025022031-A1 | NEW DERIVATIVES USEFUL AS ANTIBACTERIAL AGENTS | CONSEJO SUPERIOR DE INVESTIGACIONES CIENTÍFICAS (CSIC) (ES) | 2025-01-30 | — | — | WO | disclosed |