Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL9872353

Cc1ccc(N2CCN(CCc3sc(N)nc3-c3ccccc3)CC2)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 17)

geneUniProtsupporting neighboursconfidence
ADRA1D known ✓ P25100 1/20 0.44
ADRA1A known ✓ P35348 1/20 0.44
ADRA1B known ✓ P35368 1/20 0.44
SLC6A2 known ✓ P23975 1/20 0.42
MAPT P10636 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47
ALDH1A1 P00352 2/20 0.44
GAA P10253 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
CYP1A2 P05177 1/20 0.44
SLC6A4 P31645 2/20 0.42
KDM5B Q9UGL1 1/20 0.42
HTR1A P08908 2/20 0.41
DRD2 P14416 4/20 0.40
DRD3 P35462 4/20 0.40
DRD4 P21917 1/20 0.40
HTR7 P34969 1/20 0.40

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
SCHEMBL7275861 0.91 MAPT (0.55) MAPTNPSR1ALDH1A1ADRA1DADRA1A
Cadaverine Tartrate SCHEMBL9870596 0.91 HTR1A (0.45) ALDH1A1CYP1A2SLC6A4HTR1ADRD2
Cadaverine Tartrate SCHEMBL9871114 0.90 HTR1A (0.49) ALDH1A1HTR1ADRD2
Cadaverine Tartrate SCHEMBL9870639 0.86 PARP1 (0.46) MAPTALDH1A1CYP1A2SLC6A4HTR1A
Cadaverine Tartrate SCHEMBL9872027 0.86 SIGMAR1 (0.51) MAPTADRA1ACYP1A2HTR1ADRD2
SCHEMBL7277915 0.81 CACNA1G (0.48) MAPTALDH1A1HTR1ADRD2DRD3
SCHEMBL7268941 0.81 HSD17B10 (0.51) MAPTALDH1A1HTR1ADRD2DRD3
Cadaverine Tartrate SCHEMBL9871618 0.80 DRD2 (0.44) CYP1A2HTR1ADRD2DRD3DRD4
Cadaverine Tartrate SCHEMBL9871625 0.80 DRD2 (0.44) CYP1A2HTR1ADRD2DRD3DRD4
Cadaverine Tartrate SCHEMBL9871896 0.80 HTR1A (0.47) ADRA1ACYP1A2SLC6A2HTR1ADRD2

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
US-5071864-A Administering for high blood pressure and central nervous syst em disorders BASF AKTIENGESELLSCHAFT (DE) 1991-12-10 US disclosed