Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Pivalate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| Pivalate SCHEMBL3093699 | 0.96 | CA1 (0.43) | — | |
| Pivalate SCHEMBL2204587 | 0.88 | CA1 (0.43) | — | |
| Pivalate SCHEMBL6511225 | 0.88 | CA1 (0.43) | — | |
| Pivalate SCHEMBL4652796 | 0.88 | CA1 (0.43) | — | |
| Pivalate SCHEMBL300631 | 0.88 | CA1 (0.43) | — | |
| Pivalate SCHEMBL25243131 | 0.88 | CA1 (0.43) | — | |
| Pivalate SCHEMBL1314523 | 0.88 | CA1 (0.43) | — | |
| Pivalate SCHEMBL2349136 | 0.88 | — | — | |
| Pivalate SCHEMBL1043179 | 0.88 | — | — | |
| Pivalate SCHEMBL1685640 | 0.88 | CA1 (0.43) | — |
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-2025040517-A1 | METHOD FOR PRODUCING A LAYER COMPOSED OF PEROVSKITE, LAYER COMPOSED OF PEROVSKITE AND USE OF THE LAYER COMPOSED OF PEROVSKITE | Friedrich-Alexander-Universität Erlangen-Nürnberg, Körperschaft des öffentlichen Rechts (DE) | 2025-02-27 | — | — | WO | disclosed |