Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Butyric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | CDC25A | P30304 | 1/20 | 0.46 |
| ▸ | CDC25B | P30305 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.43 |
| ▸ | MYC | P01106 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Butyric Acid SCHEMBL121030 | 0.97 | KDM4E (0.51) | KDM4EHSD17B10CDC25ACDC25BTDP1 | |
| Terephthalic Acid SCHEMBL7237482 | 0.95 | KDM4E (0.50) | KDM4EHSD17B10CDC25ACDC25BTDP1 | |
| Succinic Acid SCHEMBL124833 | 0.91 | KDM4E (0.53) | KDM4EHSD17B10CDC25ACDC25BTDP1 | |
| Succinic Acid SCHEMBL4766771 | 0.86 | KDM4E (0.58) | KDM4EHSD17B10CDC25ACDC25BTDP1 | |
| Acetic Acid SCHEMBL28378940 | 0.86 | KDM4E (0.62) | KDM4EHSD17B10CDC25ACDC25BTDP1 | |
| Acetic Acid SCHEMBL28378441 | 0.86 | KDM4E (0.62) | KDM4EHSD17B10CDC25ACDC25BTDP1 | |
| Acetic Acid SCHEMBL39490 | 0.86 | KDM4E (0.62) | KDM4EHSD17B10CDC25ACDC25BTDP1 | |
| Acetic Acid SCHEMBL28658551 | 0.86 | KDM4E (0.62) | KDM4EHSD17B10CDC25ACDC25BTDP1 | |
| Propionic Acid SCHEMBL122758 | 0.84 | KDM4E (0.56) | KDM4EHSD17B10CDC25ACDC25BTDP1 | |
| Stearic Acid SCHEMBL31233978 | 0.84 | GPR84 (0.53) | HSD17B10TDP1PTPN1PTPN11ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101299992-A | Carboxyalkyl cellulose esters for the long-acting delivery of pharmaceutically active substances | EASTMAN CHEM CO (US) | 2008-11-05 | — | — | CN | disclosed |
| CN-101299993-A | Carboxyalkylcellulose esters for administration of poorly soluble pharmaceutically active agents | EASTMAN CHEM CO (US) | 2008-11-05 | — | — | CN | disclosed |