Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL5330974

CC(C)Oc1ccc(F)cc1N1CCN(CC(O)CN2C(=O)C3CC(O)C(O)CC3C2=O)CC1.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.44

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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 7)

geneUniProtsupporting neighboursconfidence
ADRA1D known ✓ P25100 16/20 0.44
ADRA1A known ✓ P35348 16/20 0.44
ADRA1B known ✓ P35368 5/20 0.41
DRD2 P14416 4/20 0.41
HTR1A P08908 3/20 0.41
HTR7 P34969 3/20 0.41
HTR6 P50406 1/20 0.39

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
SCHEMBL4530520 0.95 ADRA1D (0.46) ADRA1DADRA1AADRA1BDRD2HTR1A
Hydrochloric Acid SCHEMBL4522464 0.94 ADRA1D (0.45) ADRA1DADRA1AADRA1BDRD2HTR1A
Succinic Acid SCHEMBL5328546 0.93 ADRA1D (0.44) ADRA1DADRA1AADRA1BDRD2HTR1A
Maleic Acid SCHEMBL5329672 0.92 ADRA1D (0.44) ADRA1DADRA1AADRA1BDRD2HTR1A
Fumaric Acid SCHEMBL5329684 0.92 ADRA1D (0.44) ADRA1DADRA1AADRA1BDRD2HTR1A
Phosphoric Acid SCHEMBL5327007 0.91 ADRA1D (0.45) ADRA1DADRA1AADRA1BDRD2HTR1A
Cadaverine Tartrate SCHEMBL5327784 0.88 ADRA1D (0.42) ADRA1DADRA1AADRA1BDRD2
Cadaverine Tartrate SCHEMBL5332836 0.88 DRD2 (0.44) ADRA1DADRA1AADRA1BDRD2HTR1A
Cadaverine Tartrate SCHEMBL5303496 0.87 ADRA1D (0.47) ADRA1DADRA1AADRA1BDRD2HTR1A
Cadaverine Tartrate SCHEMBL5332008 0.87 HTR1A (0.38) DRD2HTR1AHTR7HTR6

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