Known targets — ChEMBL curated mechanism
AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA
The experimentally established mechanism targets of (R)-3-Hydroxybutanoate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
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 | |
|---|---|---|---|---|
| (R)-3-Hydroxybutanoate SCHEMBL19460661 | 0.97 | — | — | |
| (R)-3-Hydroxybutanoate SCHEMBL1284427 | 0.97 | — | — | |
| (R)-3-Hydroxybutanoate SCHEMBL22321684 | 0.97 | — | — | |
| (R)-3-Hydroxybutanoate SCHEMBL194589 | 0.92 | — | — | |
| (R)-3-Hydroxybutanoate SCHEMBL1330790 | 0.92 | — | — | |
| (R)-3-Hydroxybutanoate SCHEMBL20518506 | 0.92 | CA2 (0.57) | — | |
| (R)-3-Hydroxybutanoate SCHEMBL21060562 | 0.92 | CA2 (0.57) | — | |
| (R)-3-Hydroxybutanoate SCHEMBL19459352 | 0.92 | CA2 (0.57) | — | |
| (R)-3-Hydroxybutanoate SCHEMBL7209004 | 0.92 | CA2 (0.57) | — | |
| (R)-3-Hydroxybutanoate SCHEMBL22321678 | 0.92 | CA2 (0.57) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210338613-A1 | FORMULATIONS AND METHODS FOR TRANSDERMAL ADMINISTRATION OF KETONES | DYVE BIOSCIENCES, INC. (US) | 2021-11-04 | — | — | US | disclosed |
| US-20200068939-A1 | Nutritional compositions to increase and sustain blood ketone levels | TRUIST BANK, AS ADMINISTRATIVE AGENT | 2020-03-05 | — | — | US | disclosed |