Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL7157449

COC(=O)C1(c2ccc(I)cc2)CC2CCC(C1)N2C.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

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 5)

geneUniProtsupporting neighboursconfidence
SLC6A3 known ✓ Q01959 10/20 0.39
SLC6A2 known ✓ P23975 6/20 0.39
OPRM1 known ✓ P35372 1/20 0.39
SLC6A4 P31645 10/20 0.39
SIGMAR1 Q99720 1/20 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
SCHEMBL1012066 0.93 SLC6A4 (0.43) SLC6A4SLC6A3SLC6A2OPRM1
SCHEMBL7568500 0.82 CYP2D6 (0.48) SLC6A4SLC6A3SLC6A2OPRM1
SCHEMBL7464514 0.82 SLC6A2 (0.48) SLC6A4SLC6A3SLC6A2OPRM1
SCHEMBL1012743 0.82 SLC6A2 (0.48) SLC6A4SLC6A3SLC6A2OPRM1
SCHEMBL7156275 0.81 OPRM1 (0.47) SLC6A4SLC6A3SLC6A2OPRM1
SCHEMBL3656139 0.80 ALDH1A1 (0.47) SLC6A4SLC6A3SLC6A2OPRM1
SCHEMBL5730907 0.80 OPRM1 (0.40) OPRM1
SCHEMBL8347022 0.78 HRH3 (0.37) SLC6A4SLC6A3SLC6A2OPRM1
SCHEMBL7160342 0.77 ALDH1A1 (0.35) SLC6A4SLC6A3SLC6A2
SCHEMBL15956392 0.74 OPRM1 (0.46) SLC6A4SLC6A3SLC6A2OPRM1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6537522-B1 Metabolically stable cocaine analogs such as 2-carbometh-oxy-3-(4-iodophenyl)-tropane; chemical intermediates for compounds having high affinities for dopamine and serotonin reuptake sites in brain AMERSHAM PLC (GB) 2003-03-25 US disclosed
EP-0703791-B1 AN IODINATED NEUROPROBE FOR MAPPING MONOAMINE REUPTAKE SITES RES BIOCHEMICALS LTD PATERNERS (US) 2002-12-04 EP disclosed
US-5750089-A Halogenated neuroprobe for mapping monoamine reuptake sites NEURO IMAGING TECHNOLOGIES, LLC (US) 1998-05-12 US disclosed
US-5698179-A Iodinated neuroprobe for mapping monoamine reuptake sites NEURO IMAGING TECHNOLOGIES, LLC (US) 1997-12-16 US disclosed
EP-0703791-A4 AN IODINATED NEUROPROBE FOR MAPPING MONOAMINE REUPTAKE SITES RES BIOMED LP (US) 1996-05-22 EP disclosed
EP-0703791-A1 AN IODINATED NEUROPROBE FOR MAPPING MONOAMINE REUPTAKE SITES RESEARCH BIOMEDICALS LIMITED PARTNERSHIP (US) 1996-04-03 EP disclosed
US-5439666-A Central nervous system RESEARCH BIOCHEMICALS LIMITED PARTNERSHIP (US) 1995-08-08 US disclosed
WO-1995001184-A1 AN IODINATED NEUROPROBE FOR MAPPING MONOAMINE REUPTAKE SITES RESEARCH BIOCHEMICALS LIMITED PARTNERSHIP (US) 1995-01-12 WO disclosed
US-5310912-A Ester-substituted nortropane RESEARCH BIOCHEMICALS LIMITED PARTNERSHIP (US) 1994-05-10 US disclosed