Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL5326142

CC(C)Oc1ccc(F)cc1N1CCN(CCCN2C(=O)C3CC(O)C(F)CC3C2=O)CC1.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.41

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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 8)

geneUniProtsupporting neighboursconfidence
HTR2A known ✓ P28223 1/20 0.41
ADRA1A known ✓ P35348 12/20 0.41
ADRA1D known ✓ P25100 11/20 0.41
ADRA1B known ✓ P35368 7/20 0.41
DRD2 P14416 3/20 0.41
HTR1A P08908 1/20 0.41
DRD3 P35462 2/20 0.38
DRD4 P21917 2/20 0.36

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
Cadaverine Tartrate SCHEMBL5332836 0.96 DRD2 (0.44) DRD2HTR1AHTR2AADRA1AADRA1D
SCHEMBL4532832 0.94 DRD2 (0.45) DRD2HTR1AHTR2AADRA1AADRA1D
Hydrochloric Acid SCHEMBL4537655 0.94 HTR1A (0.45) DRD2HTR1AHTR2AADRA1AADRA1D
Succinic Acid SCHEMBL5295477 0.93 DRD2 (0.42) DRD2HTR1AHTR2AADRA1AADRA1D
Maleic Acid SCHEMBL5328757 0.92 DRD2 (0.41) DRD2HTR1AHTR2AADRA1AADRA1D
Fumaric Acid SCHEMBL5328765 0.92 DRD2 (0.41) DRD2HTR1AHTR2AADRA1AADRA1D
Cadaverine Tartrate SCHEMBL5329652 0.92 DRD2 (0.47) DRD2HTR1AHTR2AADRA1AADRA1D
Phosphoric Acid SCHEMBL5330466 0.91 HTR1A (0.43) DRD2HTR1AHTR2AADRA1AADRA1D
Cadaverine Tartrate SCHEMBL5329464 0.91 DRD2 (0.47) DRD2HTR1AHTR2AADRA1AADRA1D
SCHEMBL14541002 0.90 DRD2 (0.48) 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