Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL3633165

CC(=O)NCc1ccc(-c2ccc(C)c(C)c2)cc1.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.48

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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 20)

geneUniProtsupporting neighboursconfidence
ADAMTS4 O75173 1/20 0.48
MMP13 P45452 1/20 0.48
KMT2A Q03164 2/20 0.48
NR1H4 Q96RI1 1/20 0.47
HDAC1 Q13547 6/20 0.46
VHL P40337 1/20 0.44
HDAC2 Q92769 4/20 0.43
HDAC8 Q9BY41 4/20 0.43
HDAC3 O15379 3/20 0.43
HDAC11 Q96DB2 2/20 0.43
HDAC4 P56524 1/20 0.43
MAPT P10636 5/20 0.42
GAA P10253 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
TP53 P04637 1/20 0.41
RORC P51449 1/20 0.41
ALDH1A1 P00352 2/20 0.41
RAB9A P51151 2/20 0.41
POLB P06746 1/20 0.41
MEN1 O00255 1/20 0.41

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 SCHEMBL9938548 0.86 KMT2A (0.55) ADAMTS4MMP13KMT2AHDAC1VHL
Cadaverine Tartrate SCHEMBL9938634 0.83 KMT2A (0.53) ADAMTS4MMP13KMT2AHDAC1VHL
Cadaverine Tartrate SCHEMBL9937385 0.83 KMT2A (0.53) ADAMTS4MMP13KMT2AHDAC1HDAC2
Cadaverine Tartrate SCHEMBL9936743 0.81 ADAMTS4 (0.53) ADAMTS4MMP13KMT2AHDAC1VHL
Cadaverine Tartrate SCHEMBL3634786 0.78 PPARA (0.51) ADAMTS4MMP13KMT2AHDAC1HDAC2
SCHEMBL5724755 0.77 ALDH1A1 (0.55) MMP13KMT2ANR1H4HDAC1VHL
Cadaverine Tartrate SCHEMBL3633167 0.76 RARB (0.41) ALDH1A1
SCHEMBL5801663 0.74 KMT2A (0.65) ADAMTS4MMP13KMT2ANR1H4HDAC1
SCHEMBL12133623 0.72 KMT2A (0.76) KMT2AHDAC1VHLHDAC2HDAC8
SCHEMBL5437522 0.71 KDM4E (0.59) ADAMTS4MMP13KMT2AHDAC1VHL

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
EP-2152865-A1 METHODS OF TREATMENT AND PREVENTION OF NEURODEGENERATIVE DISEASES AND DISORDERS THOMAS JEFFERSON UNIVERSITY (US) 2010-02-17 EP disclosed
WO-2008140449-A1 METHODS OF TREATMENT AND PREVENTION OF NEURODEGENERATIVE DISEASES AND DISORDERS THOMAS JEFFERSON UNIVERSITY (US) 2008-11-20 WO disclosed