Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL5330833

CCCOc1ccc(F)cc1N1CCN(CCCN2C(=O)C3CC(O)C(O)CC3C2=O)CC1.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.43

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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 15)

geneUniProtsupporting neighboursconfidence
HTR2A known ✓ P28223 2/20 0.43
ADRA1A known ✓ P35348 4/20 0.41
ADRA1D known ✓ P25100 3/20 0.41
ADRA1B known ✓ P35368 3/20 0.41
DRD2 P14416 5/20 0.43
HTR1A P08908 3/20 0.43
DRD3 P35462 3/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
HTR2C P28335 2/20 0.38
SLC6A4 P31645 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
HTR7 P34969 1/20 0.37

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
SCHEMBL4530606 0.94 DRD2 (0.47) DRD2HTR1AHTR2AADRA1AADRA1D
Hydrochloric Acid SCHEMBL4515496 0.93 DRD2 (0.47) DRD2HTR1AHTR2AADRA1AADRA1D
Succinic Acid SCHEMBL5331536 0.93 DRD2 (0.43) DRD2HTR1AHTR2AADRA1AADRA1D
Fumaric Acid SCHEMBL5328856 0.92 DRD2 (0.43) DRD2HTR1AHTR2AADRA1AADRA1D
Maleic Acid SCHEMBL5328849 0.92 DRD2 (0.43) DRD2HTR1AHTR2AADRA1AADRA1D
Phosphoric Acid SCHEMBL5330059 0.91 DRD2 (0.45) DRD2HTR1AHTR2AADRA1AADRA1D
Cadaverine Tartrate SCHEMBL5332836 0.88 DRD2 (0.44) DRD2HTR1AHTR2AADRA1AADRA1D
Cadaverine Tartrate SCHEMBL5329652 0.86 DRD2 (0.47) DRD2HTR1AHTR2AADRA1AADRA1D
Cadaverine Tartrate SCHEMBL5329934 0.85 HTR1A (0.43) DRD2HTR1AHTR2AADRA1AADRA1D
Cadaverine Tartrate SCHEMBL5326142 0.85 DRD2 (0.41) DRD2HTR1AHTR2AADRA1AADRA1D

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007010504-A2 ACID ADDITION SALTS OF ISOINDOLES ACTING AS ADRENERGIC RECEPTOR ANTAGONISTS RANBAXY LABORATORIES LIMITED (IN) 2007-01-25 WO disclosed