Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL13685348

Clc1ccc2c(c1NCc1ccc(CSC3CCCC3)cc1)CCNCC2.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.39

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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 8)

geneUniProtsupporting neighboursconfidence
HTR2A known ✓ P28223 2/20 0.33
OPRD1 known ✓ P41143 1/20 0.31
KMT2A Q03164 1/20 0.39
HTR2C P28335 2/20 0.33
HTR2B P41595 2/20 0.33
APEX1 P27695 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31

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
Cadaverine Tartrate SCHEMBL13685383 0.99 KMT2A (0.40) KMT2AHTR2AHTR2CHTR2BAPEX1
SCHEMBL2581682 0.91 HTR2B (0.40) KMT2AHTR2AHTR2CHTR2B
SCHEMBL2586596 0.90 HTR2B (0.39) KMT2AHTR2AHTR2CHTR2B
Cadaverine Tartrate SCHEMBL13685345 0.90 KMT2A (0.30) KMT2A
Cadaverine Tartrate SCHEMBL13685426 0.89 KMT2A (0.33) KMT2A
Cadaverine Tartrate SCHEMBL4922898 0.89 KMT2A (0.31) KMT2A
Cadaverine Tartrate SCHEMBL13685310 0.89 KMT2A (0.34) KMT2A
Cadaverine Tartrate SCHEMBL4917848 0.89 KMT2A (0.32) KMT2A
Cadaverine Tartrate SCHEMBL13685398 0.84 HTR2A (0.33) HTR2AHTR2CHTR2BAPEX1BLM
Cadaverine Tartrate SCHEMBL13685476 0.82 HDAC3 (0.33) HTR2AHTR2CHTR2B

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
EP-1924561-B1 6-ARYLALKYLAMINO- 2,3,4,5-TETRAHYDRO-1H-BENZO[D]AZEPINES AS 5-HT2C RECEPTOR AGONISTS LILLY CO ELI (US) 2012-11-14 EP claimed