Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL10560366

NCCc1ccc(C(F)(F)F)cc1.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.68

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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 17)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.68
MAOB P27338 3/20 0.60
DHODH Q02127 1/20 0.45
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
FFAR1 O14842 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
PDPK1 O15530 1/20 0.43
SRD5A2 P31213 1/20 0.43
PLAAT3 P53816 1/20 0.43
PLAAT5 Q96KN8 1/20 0.43
PLAAT2 Q9NWW9 1/20 0.43
PLAAT4 Q9UL19 1/20 0.43
IDO1 P14902 2/20 0.42
GRB2 P62993 1/20 0.42
CNR1 P21554 1/20 0.42

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
Acetic Acid SCHEMBL29202185 0.85 TAAR1 (0.75) TAAR1MAOBDHODHFFAR1HDAC1
SCHEMBL625402 0.82 TAAR1 (1.00) TAAR1MAOBIDO1
Cadaverine Tartrate SCHEMBL3634787 0.81 MAOB (0.49) TAAR1MAOBPPARGPPARAFFAR1
Bromide SCHEMBL28801000 0.80 TAAR1 (0.95) TAAR1MAOBIDO1
Iodide SCHEMBL28689118 0.80 TAAR1 (0.95) TAAR1MAOBIDO1
Hydrochloric Acid SCHEMBL4369846 0.80 TAAR1 (0.95) TAAR1MAOBIDO1
Cadaverine Tartrate SCHEMBL31121656 0.79 HTR2A (0.64) TAAR1FFAR1HDAC1HDAC8
SCHEMBL22341165 0.76 EPHX2 (0.69) TAAR1MAOBCNR1
SCHEMBL31377022 0.76 TAAR1 (0.78) TAAR1MAOBIDO1
Hydrochloric Acid SCHEMBL30558891 0.75 MAOB (1.00) TAAR1MAOBIDO1

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-4857553-A SIDE EFFECT REDUCTION A. H. ROBINS COMPANY, INCORPORATED (US) 1989-08-15 US disclosed
EP-0302757-A2 Anti-emetic serotonin depleting agents A.H. ROBINS COMPANY, INCORPORATED (US) 1989-02-08 EP disclosed