Aloe-Emodin

Aloe-Emodin

SCHEMBL5857045

CC(=O)O.O=C1c2cccc(O)c2C(=O)c2c(O)cc(CO)cc21

nearest known ligand 0.86

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Aloe-Emodin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.86
KMT2A Q03164 3/20 0.86
MAOA P21397 3/20 0.86
MAOB P27338 2/20 0.86
EPHX2 P34913 1/20 0.86
ALDH1A1 P00352 3/20 0.59
MAPT P10636 3/20 0.59
TSHR P16473 3/20 0.59
TDP1 Q9NUW8 3/20 0.59
KDM4E B2RXH2 2/20 0.59
CYP3A4 P08684 2/20 0.59
RECQL P46063 2/20 0.59
LMNA P02545 2/20 0.59
HPGD P15428 2/20 0.59
ALOX15 P16050 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
HSD17B10 Q99714 2/20 0.59
FTO Q9C0B1 2/20 0.59
TTR P02766 1/20 0.59
BCHE P06276 1/20 0.59

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.

Compoundsimilaritytop predictedshared targets
Aloe-Emodin SCHEMBL8929970 1.00 MEN1 (0.86) MEN1KMT2AMAOAMAOBEPHX2
Aloe-Emodin SCHEMBL28079854 0.93 MEN1 (0.94) MEN1KMT2AMAOAMAOBEPHX2
Aloe-Emodin SCHEMBL29398579 0.93 MEN1 (1.00) MEN1KMT2AMAOAMAOBEPHX2
Aloe-Emodin SCHEMBL309756 0.93 MEN1 (1.00) MEN1KMT2AMAOAMAOBEPHX2
Aloe-Emodin SCHEMBL29814516 0.93 MEN1 (1.00) MEN1KMT2AMAOAMAOBEPHX2
Aloe-Emodin SCHEMBL28756496 0.90 MEN1 (0.89) MEN1KMT2AMAOAMAOBEPHX2
Aloe-Emodin SCHEMBL8827767 0.90 MEN1 (0.94) MEN1KMT2AMAOAMAOBEPHX2
Rhein SCHEMBL5017539 0.88 MEN1 (0.80) MEN1KMT2AMAOAMAOBEPHX2
Aloe-Emodin SCHEMBL972434 0.88 MEN1 (0.84) MEN1KMT2AMAOAMAOBEPHX2
SCHEMBL13475629 0.84 MEN1 (0.78) MEN1KMT2AMAOAMAOBEPHX2

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE39199-E1 Antipsoriatic compositions, method of making, and method of using MOADY NASEBA 2006-07-18 US claimed
EP-0906114-B1 ANTIPSORIATIC COMPOSITIONS COMPRISING AN ASPHODELUS EXTRACT, METHOD OF MAKING, AND METHOD OF USING MOADY SAID (US) 2002-06-26 EP claimed
EP-1166791-A2 Antipsoriatic compositions comprising an asphodelus extract, method of making, and method of using Moady, Said (US) 2002-01-02 EP claimed
US-5955081-A TREATMENT OF SKIN DISORDERS WITH PLANT EXTRACTS Z-92, INC. 1999-09-21 US claimed
EP-0906114-A2 ANTIPSORIATIC COMPOSITIONS, METHOD OF MAKING, AND METHOD OF USING Moady, Said (US) 1999-04-07 EP claimed
US-5852060-A Antipsoriatic compositions, method of making, and method of using MOADY MARZOOK (US) 1998-12-22 US claimed
WO-1997034568-A2 ANTIPSORIATIC COMPOSITIONS, METHOD OF MAKING, AND METHOD OF USING MOADY, SAID (US) 1997-09-25 WO claimed
WO-2017137887-A1 COMPOSITION OF ASPHODELUS ROOT EXTRACTS CECCOBELLI PIETRO (IT) 2017-08-17 WO disclosed
US-RE39199-E1 Antipsoriatic compositions, method of making, and method of using MOADY NASEBA 2006-07-18 US disclosed
US-RE39199-E1 Antipsoriatic compositions, method of making, and method of using MOADY NASEBA 2006-07-18 US disclosed
EP-1166791-A3 Antipsoriatic compositions comprising an asphodelus extract, method of making, and method of using Moady, Said (US) 2003-01-08 EP disclosed
EP-0906114-B1 ANTIPSORIATIC COMPOSITIONS COMPRISING AN ASPHODELUS EXTRACT, METHOD OF MAKING, AND METHOD OF USING MOADY SAID (US) 2002-06-26 EP disclosed
EP-0906114-B1 ANTIPSORIATIC COMPOSITIONS COMPRISING AN ASPHODELUS EXTRACT, METHOD OF MAKING, AND METHOD OF USING MOADY SAID (US) 2002-06-26 EP disclosed
US-5852060-A Antipsoriatic compositions, method of making, and method of using MOADY MARZOOK (US) 1998-12-22 US disclosed
US-5852060-A Antipsoriatic compositions, method of making, and method of using MOADY MARZOOK (US) 1998-12-22 US disclosed
WO-1997034568-A3 ANTIPSORIATIC COMPOSITIONS, METHOD OF MAKING, AND METHOD OF USING 1997-10-23 WO disclosed
WO-1997034568-A2 ANTIPSORIATIC COMPOSITIONS, METHOD OF MAKING, AND METHOD OF USING MOADY, SAID (US) 1997-09-25 WO disclosed
WO-1997034568-A2 ANTIPSORIATIC COMPOSITIONS, METHOD OF MAKING, AND METHOD OF USING MOADY, SAID (US) 1997-09-25 WO disclosed
US-5652265-A Production of rhein and rhein derivatives WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1997-07-29 US disclosed
WO-1996030034-A1 PRODUCTION OF RHEIN AND RHEIN DERIVATIVES WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1996-10-03 WO disclosed