Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL9937388

NC(=O)CCc1ccc(-c2ccc(Cl)cc2)cc1.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.49

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Known targets — ChEMBL curated mechanism

ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3CHRM1CHRM2CHRM3CHRM4ESR1ESR2GABRA1GABRB1GABRG2GBA1HRH1HTR1DHTR2AOPRD1OPRK1OPRM1SLC6A2SLC6A3TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8rplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.47
MAOB P27338 1/20 0.46
FFAR1 O14842 2/20 0.45
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
PPARG P37231 4/20 0.43
PPARA Q07869 4/20 0.43
MCHR1 Q99705 1/20 0.43
PDPK1 O15530 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CNR1 P21554 1/20 0.42
PLAAT3 P53816 3/20 0.41
PLAAT5 Q96KN8 3/20 0.41
PLAAT2 Q9NWW9 3/20 0.41
PLAAT4 Q9UL19 3/20 0.41

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
SCHEMBL4591629 0.90 MAOB (0.55) MAP4K4MAOBFFAR1CYP2C9CYP2C19
Cadaverine Tartrate SCHEMBL9936744 0.87 ALDH1A1 (0.47) FFAR1L3MBTL1
Cadaverine Tartrate SCHEMBL9938636 0.86 ALDH1A1 (0.44) FFAR1MEN1KMT2A
Cadaverine Tartrate SCHEMBL9938552 0.86 FFAR1 (0.45) FFAR1PPARGPPARAL3MBTL1PLAAT3
SCHEMBL1990535 0.85 CYP2C9 (0.57) FFAR1CYP2C9CYP2C19PDPK1MEN1
Cadaverine Tartrate SCHEMBL3634787 0.82 MAOB (0.49) MAOBFFAR1PPARGPPARAPDPK1
Cadaverine Tartrate SCHEMBL3633167 0.81 RARB (0.41) FFAR1PPARGPPARA
SCHEMBL5801662 0.78 FFAR1 (0.71) FFAR1HTT
SCHEMBL1570003 0.76 HDAC3 (0.58) CYP2C9CYP2C19PPARGPPARAL3MBTL1
SCHEMBL11825388 0.76 PPARG (0.49) MAOBPPARGPPARACNR1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651403-A2 USE OF LP-PLA2 INHIBITORS IN THE TREATMENT AND PREVENTION OF EYE DISEASES Glaxo Group Limited (GB) 2013-10-23 EP disclosed
WO-2012080497-A2 METHODS OF TREATMENT AND PREVENTION OF EYE DISEASES GLAXO GROUP LIMITED (GB) 2012-06-21 WO disclosed