Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL5332008

O=C(O)C(O)C(O)C(=O)O.O=C1C2CC(O)C(O)CC2C(=O)N1CC(O)CN1CCN(c2cc(F)ccc2OC2CCCC2)CC1

nearest known ligand 0.38

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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 12)

geneUniProtsupporting neighboursconfidence
HRH1 known ✓ P35367 1/20 0.36
HTR1A P08908 12/20 0.38
HTR7 P34969 12/20 0.38
DRD2 P14416 11/20 0.38
HTR6 P50406 2/20 0.36
DRD1 P21728 1/20 0.36
DRD4 P21917 1/20 0.36
DRD3 P35462 1/20 0.36
CCR3 P51677 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
PDE4D Q08499 1/20 0.35

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
SCHEMBL4517476 0.95 HTR1A (0.41) HTR1AHTR7DRD2HTR6DRD1
Cadaverine Tartrate SCHEMBL5331439 0.94 HTR1A (0.39) HTR1AHTR7DRD2HTR6DRD1
Hydrochloric Acid SCHEMBL4514047 0.94 HTR1A (0.41) HTR1AHTR7DRD2HTR6DRD1
Succinic Acid SCHEMBL5327295 0.93 HTR1A (0.38) HTR1AHTR7DRD2HTR6DRD1
Fumaric Acid SCHEMBL5329175 0.93 HTR1A (0.37) HTR1AHTR7DRD2HTR6DRD1
Maleic Acid SCHEMBL5329169 0.93 HTR1A (0.37) HTR1AHTR7DRD2HTR6DRD1
Phosphoric Acid SCHEMBL5330436 0.92 HTR1A (0.39) HTR1AHTR7DRD2HTR6DRD1
SCHEMBL4537694 0.89 HTR1A (0.42) HTR1AHTR7DRD2HTR6DRD1
Cadaverine Tartrate SCHEMBL5329934 0.89 HTR1A (0.43) HTR1AHTR7DRD2HTR6DRD3
Cadaverine Tartrate SCHEMBL5328277 0.89 MEN1 (0.36) HTR1AHTR7DRD2HRH1CCR3

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