Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL5329652

COc1ccc(F)cc1N1CCN(CCCN2C(=O)C3CC(O)C(F)CC3C2=O)CC1.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.47

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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 10)

geneUniProtsupporting neighboursconfidence
ADRA1D known ✓ P25100 4/20 0.45
ADRA1A known ✓ P35348 4/20 0.45
ADRA1B known ✓ P35368 4/20 0.45
HTR2A known ✓ P28223 2/20 0.43
DRD2 P14416 6/20 0.47
DRD3 P35462 4/20 0.47
HTR1A P08908 4/20 0.43
HTR7 P34969 1/20 0.43
HTR6 P50406 1/20 0.43
DRD4 P21917 1/20 0.42

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
SCHEMBL4537868 0.93 DRD2 (0.49) DRD2DRD3ADRA1DADRA1AADRA1B
Hydrochloric Acid SCHEMBL4515971 0.93 DRD2 (0.48) DRD2DRD3ADRA1DADRA1AADRA1B
Cadaverine Tartrate SCHEMBL5326142 0.92 DRD2 (0.41) DRD2DRD3ADRA1DADRA1AADRA1B
Succinic Acid SCHEMBL5307813 0.92 DRD2 (0.48) DRD2DRD3ADRA1DADRA1AADRA1B
Maleic Acid SCHEMBL5335594 0.91 DRD2 (0.47) DRD2DRD3ADRA1DADRA1AADRA1B
Fumaric Acid SCHEMBL5306537 0.91 DRD2 (0.47) DRD2DRD3ADRA1DADRA1AADRA1B
Phosphoric Acid SCHEMBL5302008 0.90 DRD2 (0.48) DRD2DRD3ADRA1DADRA1AADRA1B
Cadaverine Tartrate SCHEMBL5328431 0.89 HTR1A (0.40) DRD2DRD3ADRA1DADRA1AADRA1B
Cadaverine Tartrate SCHEMBL5332836 0.88 DRD2 (0.44) DRD2DRD3ADRA1DADRA1AADRA1B
Cadaverine Tartrate SCHEMBL5326750 0.87 ADRA1B (0.49) DRD2DRD3ADRA1DADRA1AADRA1B

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