Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Propylparaben. 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 | |
|---|---|---|---|---|
| ▸ | THRB known ✓ | P10828 | 1/20 | 0.48 |
| ▸ | PDE4D known ✓ | Q08499 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.60 |
| ▸ | TSHR | P16473 | 3/20 | 0.60 |
| ▸ | ESR1 | P03372 | 2/20 | 0.60 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.60 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.60 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.60 |
| ▸ | KDR | P35968 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 5/20 | 0.57 |
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | STS | P08842 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Propylparaben SCHEMBL48862 | 0.93 | ALDH1A1 (0.68) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| Propylparaben SCHEMBL8361958 | 0.92 | ALDH1A1 (0.66) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| Propylparaben SCHEMBL475797 | 0.90 | ALDH1A1 (0.68) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| SCHEMBL680463 | 0.90 | ALDH1A1 (0.72) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| Propylparaben SCHEMBL11658475 | 0.89 | ALDH1A1 (0.62) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| SCHEMBL9868709 | 0.85 | TDP1 (0.66) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| Methylparaben SCHEMBL48756 | 0.84 | CA1 (0.61) | ALDH1A1TSHRTDP1RAB9ASTS | |
| Propylparaben SCHEMBL2812584 | 0.84 | ESR1 (0.81) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| Propylparaben SCHEMBL8725346 | 0.84 | ESR1 (0.81) | ALDH1A1TSHRESR1TDP1CHRM1 | |
| Propylparaben SCHEMBL6130230 | 0.83 | ESR1 (0.86) | ALDH1A1TSHRESR1TDP1CHRM1 |
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-1169017-A1 | ANTIMICROBIAL WIPES | THE PROCTER & GAMBLE COMPANY (US) | 2002-01-09 | — | — | EP | disclosed |
| WO-2000061107-A1 | ANTIMICROBIAL | THE PROCTER & GAMBLE COMPANY (US) | 2000-10-19 | — | — | WO | disclosed |
| EP-0996422-A1 | MILD, RINSE-OFF ANTIMICROBIAL LIQUID CLEANSING COMPOSITIONS | THE PROCTER & GAMBLE COMPANY (US) | 2000-05-03 | — | — | EP | disclosed |
| EP-0984770-A1 | MILD, RINSE-OFF ANTIMICROBIAL LIQUID CLEANSING COMPOSITIONS CONTAINING ACIDIC SURFACTANTS | THE PROCTER & GAMBLE COMPANY (US) | 2000-03-15 | — | — | EP | disclosed |
| WO-1998055092-A1 | MILD, RINSE-OFF ANTIMICROBIAL LIQUID CLEANSING COMPOSITIONS | THE PROCTER & GAMBLE COMPANY (US) | 1998-12-10 | — | — | WO | disclosed |
| WO-1998055098-A1 | MILD, RINSE-OFF ANTIMICROBIAL LIQUID CLEANSING COMPOSITIONS CONTAINING ACIDIC SURFACTANTS | THE PROCTER & GAMBLE COMPANY (US) | 1998-12-10 | — | — | WO | disclosed |