Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL10322305

O=C(Cc1ccc(-n2cccn2)cc1)N(Cc1ccc(F)cc1)C1CCN(CCC2OCCCO2)CC1.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.47

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 6)

geneUniProtsupporting neighboursconfidence
OPRM1 known ✓ P35372 5/20 0.44
HTR2A known ✓ P28223 1/20 0.39
TMEM97 Q5BJF2 2/20 0.44
CCR5 P51681 10/20 0.42
CYP2D6 P10635 1/20 0.37
KCNH2 Q12809 1/20 0.37

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
SCHEMBL341231 0.95 OPRM1 (0.47) OPRM1TMEM97CCR5HTR2A
Cadaverine Tartrate SCHEMBL10322983 0.90 OPRM1 (0.51) OPRM1TMEM97CCR5HTR2ACYP2D6
Cadaverine Tartrate SCHEMBL5927236 0.89 OPRM1 (0.42) OPRM1TMEM97CCR5HTR2A
Cadaverine Tartrate SCHEMBL10321575 0.87 OPRM1 (0.44) OPRM1TMEM97CCR5HTR2ACYP2D6
Cadaverine Tartrate SCHEMBL10320325 0.87 OPRM1 (0.45) OPRM1TMEM97CCR5HTR2ACYP2D6
Cadaverine Tartrate SCHEMBL10323301 0.87 OPRM1 (0.48) OPRM1TMEM97CCR5HTR2ACYP2D6
Cadaverine Tartrate SCHEMBL10322063 0.86 OPRM1 (0.47) OPRM1TMEM97CCR5HTR2AKCNH2
Cadaverine Tartrate SCHEMBL10323019 0.86 OPRM1 (0.47) OPRM1TMEM97CCR5HTR2ACYP2D6
Cadaverine Tartrate SCHEMBL10322367 0.86 OPRM1 (0.49) OPRM1TMEM97CCR5HTR2A
Cadaverine Tartrate SCHEMBL10322706 0.85 CCR5 (0.48) OPRM1TMEM97CCR5HTR2ACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120183600-A1 NOVEL COMPOSITION FOR TREATING METABOLIC SYNDROME AND OTHER CONDITIONS CHEN CHIEN-HUNG (US) 2012-07-19 US claimed
US-20120183600-A1 NOVEL COMPOSITION FOR TREATING METABOLIC SYNDROME AND OTHER CONDITIONS CHEN CHIEN-HUNG (US) 2012-07-19 US disclosed