Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL8551708

CCc1cccc(C(=O)Nc2ccc3sc(C)c(CCN(C)CC(C)C)c3c2)c1.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.36

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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 12)

geneUniProtsupporting neighboursconfidence
MAP1LC3B Q9GZQ8 6/20 0.36
MAP1LC3A Q9H492 6/20 0.36
BRAF P15056 1/20 0.35
MCHR1 Q99705 1/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SENP5 Q96HI0 6/20 0.34
SENP2 Q9HC62 6/20 0.34
SENP1 Q9P0U3 6/20 0.34
CNR2 P34972 2/20 0.34
PPARA Q07869 1/20 0.34

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 SCHEMBL8550421 0.84 MAP1LC3B (0.41) MAP1LC3BMAP1LC3AMAPT
Cadaverine Tartrate SCHEMBL8189789 0.84 HTR1F (0.51) MAP1LC3BMAP1LC3AMAPTSMN1; SMN2
SCHEMBL8552249 0.73 F2R (0.43) MAPTKDM4E
SCHEMBL8551467 0.68 GRM5 (0.36) BRAFMAPTKDM4E
Malonic Acid SCHEMBL8548925 0.67 HTR1F (0.47) MAPTKDM4ESMN1; SMN2SENP5SENP2
Sulfuric Acid SCHEMBL8551754 0.64 TMEM97 (0.43) MCHR1MAPTKDM4ESMN1; SMN2
SCHEMBL8551441 0.64 ACKR3 (0.49) MCHR1MAPTSENP5SENP2SENP1
SCHEMBL15676754 0.64 NPC1 (0.61) MAPTKDM4ESMN1; SMN2
SCHEMBL12228481 0.63 HDAC1 (0.61) KDM4ESMN1; SMN2
SCHEMBL15676738 0.63 MEN1 (0.74) MAPTKDM4E

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
WO-1998015545-A1 NEW SEROTONIN 5-HT1F AGONISTS ELI LILLY AND COMPANY (US) 1998-04-16 WO disclosed
EP-0835869-A2 New serotonin 5-HT1F agonists ELI LILLY AND COMPANY (US) 1998-04-15 EP disclosed