Known targets — ChEMBL curated mechanism
ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | PTGER1 | P34995 | 6/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2453699 | 0.85 | POLB (0.57) | SMN1; SMN2POLBALDH1A1KDM4EMAPT | |
| SCHEMBL81112 | 0.82 | KDM4E (0.63) | POLBKDM4EMAPT | |
| Alcohol SCHEMBL15062546 | 0.79 | KDM4E (0.59) | POLBKDM4EMAPT | |
| SCHEMBL7320143 | 0.78 | LMNA (0.51) | LMNASMN1; SMN2PTGER1POLBALDH1A1 | |
| SCHEMBL4860600 | 0.77 | KDM4E (0.61) | POLBKDM4EMAPT | |
| SCHEMBL9506664 | 0.76 | KDM4E (0.59) | POLBKDM4EMAPT | |
| SCHEMBL7184663 | 0.76 | KDM4E (0.59) | POLBKDM4EMAPT | |
| SCHEMBL2802611 | 0.76 | KDM4E (0.59) | POLBKDM4EMAPT | |
| SCHEMBL8098380 | 0.75 | EGFR (0.52) | PTGER1ALDH1A1 | |
| 1,4-Butanediol SCHEMBL8461121 | 0.75 | ALDH1A1 (0.50) | LMNASMN1; SMN2ALDH1A1KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0135905-A2 | 1-(Alkyl-hydroxy-phenyl)-1-hydroxy-2-(alkylamino)-propanes | ASTA Pharma Aktiengesellschaft (DE) | 1985-04-03 | — | — | EP | disclosed |