Known targets — ChEMBL curated mechanism
AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA
The experimentally established mechanism targets of Isobutyraldehyde. 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 | |
|---|---|---|---|---|
| Isobutyraldehyde SCHEMBL17766468 | 0.92 | — | — | |
| Isobutyraldehyde SCHEMBL28150461 | 0.84 | — | — | |
| Isobutyraldehyde SCHEMBL788159 | 0.83 | ADH1B (0.38) | — | |
| Isobutyraldehyde SCHEMBL2635854 | 0.83 | ADH1B (0.38) | — | |
| Isobutyraldehyde SCHEMBL2996 | 0.83 | — | — | |
| Isobutyraldehyde SCHEMBL18287436 | 0.83 | — | — | |
| Isobutyraldehyde SCHEMBL28152357 | 0.81 | — | — | |
| Isobutyraldehyde SCHEMBL3458543 | 0.79 | — | — | |
| Isobutyraldehyde SCHEMBL5665993 | 0.79 | — | — | |
| Isobutyraldehyde SCHEMBL9404976 | 0.79 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0769000-B1 | A PROCESS (II) FOR MAKING POTASSIUM FORMATE | PERSTORP AB (SE) | 1999-12-01 | — | — | EP | claimed |
| EP-2121557-B1 | PROCESS FOR PRODUCING POTASSIUM FORMATE | PERSTORP SPECIALTY CHEM AB (SE) | 2016-11-23 | — | — | EP | disclosed |
| US-8158822-B2 | Process for producing potassium formate | PERSTORP SPECIALTY CHEMICALS AB (SE) | 2012-04-17 | — | — | US | disclosed |
| US-20100087678-A1 | PROCESS FOR PRODUCING POTASSIUM FORMATE | PERSTORP SPECIALTY CHEMICALS AB (SE) | 2010-04-08 | — | — | US | disclosed |
| EP-2121557-A1 | PROCESS FOR PRODUCING POTASSIUM FORMATE | Perstorp Specialty Chemicals AB (SE) | 2009-11-25 | — | — | EP | disclosed |
| WO-2008091186-A1 | PROCESS FOR PRODUCING POTASSIUM FORMATE | PERSTORP SPECIALTY CHEMICALS AB (SE) | 2008-07-31 | — | — | WO | disclosed |