Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL9710674

Clc1cncc(C2CN3CCC2CC3)n1.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.76

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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 13)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
ALOX15 P16050 2/20 0.35
KDM4E B2RXH2 1/20 0.35
BLM P54132 1/20 0.35
HTR3E A5X5Y0 1/20 0.34
HTR3B O95264 1/20 0.34
TSHR P16473 1/20 0.34
HTR3A P46098 1/20 0.34
HTR3D Q70Z44 1/20 0.34
HTR3C Q8WXA8 1/20 0.34
GLA P06280 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 SCHEMBL9710670 1.00 CHRNA7 (0.35) CHRNA7NPC1RAB9AALOX15KDM4E
SCHEMBL5025977 0.87 CHRNA7 (0.41) CHRNA7
Maleic Acid SCHEMBL9854125 0.86 CHRNA7 (0.39) CHRNA7
Maleic Acid SCHEMBL194353 0.86 CHRNA7 (0.39) CHRNA7
Maleic Acid SCHEMBL29496245 0.86 CHRNA7 (0.39) CHRNA7
Cadaverine Tartrate SCHEMBL9171335 0.82 KDM4E (0.33) CHRNA7ALOX15KDM4EBLM
Cadaverine Tartrate SCHEMBL9168257 0.82 KDM4E (0.33) CHRNA7ALOX15KDM4EBLM
SCHEMBL9459002 0.80 CHRM2 (0.40)
SCHEMBL8961518 0.76 CHRNA7 (0.41) CHRNA7
Oxalic Acid SCHEMBL9459416 0.74 CHRNA7 (0.39) CHRNA7

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
EP-0470668-A1 A process for preparing enantiomers of compounds having muscarinic activity MERCK SHARP & DOHME LTD. (GB) 1992-02-12 EP disclosed
US-5073557-A Cognition activators, stimulants of central muscarinic acetylc holine receptors MERCK SHARP & DOHME LIMITED (GB) 1991-12-17 US disclosed
EP-0416754-A2 A novel substituted pyrazine, formulations thereof and use in medicine MERCK SHARP & DOHME LTD. (GB) 1991-03-13 EP disclosed