Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL8437270

CCCCCCCCCCCC[N+](C)(C)C.O=C([O-])C(O)C(O)C(=O)O

nearest known ligand 0.52

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Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3BCHECHRM1CHRM2CHRM3CHRM4CHRNA3CHRNA4CHRNB2CHRNB4ESR1ESR2GABRA1GABRB1GABRG2GBA1GHSRHRH1HTR1DHTR2AMAOBOPRD1OPRK1OPRM1SLC6A2SLC6A3TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8UGCGrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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
ACHE known ✓ P22303 1/20 0.38
DNM1 Q05193 6/20 0.52
APAF1 O14727 1/20 0.48
HSP90AA1 P07900 1/20 0.48
RAD52 P43351 1/20 0.48
TSHR P16473 2/20 0.44
LMNA P02545 2/20 0.44
PMP22 Q01453 2/20 0.44
CYP3A4 P08684 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
BLM P54132 1/20 0.44
GPR84 Q9NQS5 3/20 0.43
FFAR1 O14842 1/20 0.43
CA2 P00918 1/20 0.41
LSS P48449 1/20 0.39
CA1 P00915 1/20 0.39
MEN1 O00255 2/20 0.38
NFKB1 P19838 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38

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 SCHEMBL8435543 1.00 DNM1 (0.52) DNM1APAF1HSP90AA1RAD52TSHR
Cetrimonium SCHEMBL5533047 1.00 DNM1 (0.52) DNM1APAF1HSP90AA1RAD52TSHR
Cetrimonium SCHEMBL5533041 0.95 DNM1 (0.58) DNM1APAF1HSP90AA1RAD52TSHR
Cadaverine Tartrate SCHEMBL8437267 0.95 DNM1 (0.58) DNM1APAF1HSP90AA1RAD52TSHR
Cadaverine Tartrate SCHEMBL8435538 0.95 DNM1 (0.58) DNM1APAF1HSP90AA1RAD52TSHR
Cetrimonium SCHEMBL8437348 0.93 DNM1 (0.60) DNM1APAF1HSP90AA1RAD52TSHR
Hexamethonium SCHEMBL2822862 0.93 PMP22 (0.49) DNM1TSHRLMNAPMP22CYP3A4
Cadaverine Tartrate SCHEMBL8437269 0.93 DNM1 (0.60) DNM1APAF1HSP90AA1RAD52TSHR
Cadaverine Tartrate SCHEMBL8435540 0.93 DNM1 (0.60) DNM1APAF1HSP90AA1RAD52TSHR
Hexamethonium SCHEMBL2822866 0.87 MEN1 (0.50) DNM1APAF1HSP90AA1RAD52TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11485915-B2 Methods of using ionic liquids as corrosion inhibitors BAKER HUGHES HOLDINGS LLC (US) 2022-11-01 US disclosed
US-20220098494-A1 METHODS OF USING IONIC LIQUIDS AS CORROSION INHIBITORS BAKER HUGHES HOLDINGS LLC 2022-03-31 US disclosed
US-5933693-A Electroconductive elastic member and electrophotographic apparatus using same BRIDGESTONE CORPORATION (JP) 1999-08-03 US disclosed