Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of 1-Pentanol. 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 | |
|---|---|---|---|---|
| ▸ | ESR1 known ✓ | P03372 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.71 |
| ▸ | TSHR | P16473 | 5/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.67 |
| ▸ | LMNA | P02545 | 2/20 | 0.67 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.67 |
| ▸ | MEN1 | O00255 | 2/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.67 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.50 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.48 |
| ▸ | PPARG | P37231 | 7/20 | 0.48 |
| ▸ | PPARD | Q03181 | 7/20 | 0.48 |
| ▸ | PPARA | Q07869 | 7/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.48 |
| ▸ | TLR2 | O60603 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | FABP4 | P15090 | 2/20 | 0.48 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.48 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| 1-Pentanol SCHEMBL150165 | 1.00 | SMN1; SMN2 (0.71) | SMN1; SMN2TSHRALDH1A1LMNAHSD17B10 | |
| 1-Pentanol SCHEMBL27983494 | 1.00 | SMN1; SMN2 (0.71) | SMN1; SMN2TSHRALDH1A1LMNAHSD17B10 | |
| Nonanol SCHEMBL3168157 | 0.97 | TSHR (0.72) | SMN1; SMN2TSHRALDH1A1LMNAHSD17B10 | |
| Tridecan-1-Ol SCHEMBL20774540 | 0.97 | TSHR (0.72) | SMN1; SMN2TSHRALDH1A1LMNAHSD17B10 | |
| Undecanol SCHEMBL8054523 | 0.97 | TSHR (0.72) | SMN1; SMN2TSHRALDH1A1LMNAHSD17B10 | |
| 1-Heptanol SCHEMBL25423573 | 0.97 | TSHR (0.72) | SMN1; SMN2TSHRALDH1A1LMNAHSD17B10 | |
| Cetostearyl Alcohol SCHEMBL9576504 | 0.97 | TSHR (0.72) | SMN1; SMN2TSHRALDH1A1LMNAHSD17B10 | |
| 1-Pentanol SCHEMBL25435051 | 0.97 | SMN1; SMN2 (0.67) | SMN1; SMN2TSHRALDH1A1LMNAHSD17B10 | |
| Decanol SCHEMBL20774537 | 0.97 | TSHR (0.72) | SMN1; SMN2TSHRALDH1A1LMNAHSD17B10 | |
| 1-Heptanol SCHEMBL25433349 | 0.97 | TSHR (0.72) | SMN1; SMN2TSHRALDH1A1LMNAHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105741904-B | A kind of touch screen silver paste for mixing polyaniline | 湖南利德电子浆料股份有限公司 | 2018-07-03 | — | — | CN | disclosed |