Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL5229230

CCCN1C(=O)N2C[C@H](CC)N=C2c2[nH]c(C34CC5CC(CC3C5)C4)nc21.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.40

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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
SLC6A3 known ✓ Q01959 1/20 0.40
ADORA2A P29274 7/20 0.40
ADORA2B P29275 7/20 0.40
ADORA3 P0DMS8 4/20 0.40
ADORA1 P30542 4/20 0.40
SLC22A6 Q4U2R8 1/20 0.40
SLC22A8 Q8TCC7 1/20 0.40
SLC22A11 Q9NSA0 1/20 0.40
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
PDE5A O76074 1/20 0.31

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 SCHEMBL5227776 1.00 ADORA2A (0.40) ADORA2AADORA2BADORA3ADORA1SLC6A3
SCHEMBL6340006 0.93 ADORA2A (0.46) ADORA2AADORA2BADORA3ADORA1SLC6A3
Hydrochloric Acid SCHEMBL5225989 0.82 PDE5A (0.42) ADORA2AADORA2BADORA3ADORA1SLC6A3
Hydrochloric Acid SCHEMBL5231116 0.81 ADORA2A (0.43) ADORA2AADORA2BADORA3ADORA1SLC6A3
Hydrochloric Acid SCHEMBL5228514 0.81 ADORA2A (0.43) ADORA2AADORA2BADORA3ADORA1SLC6A3
Hydrochloric Acid SCHEMBL7652402 0.81 ADORA2A (0.44) ADORA2AADORA2BADORA3ADORA1SLC6A3
Cadaverine Tartrate SCHEMBL5227986 0.79 ADORA2B (0.35) ADORA2AADORA2BADORA3ADORA1MEN1
Cadaverine Tartrate SCHEMBL5226308 0.79 ADORA2B (0.35) ADORA2AADORA2BADORA3ADORA1MEN1
SCHEMBL7953066 0.76 ADORA3 (0.34) ADORA2AADORA2BADORA3ADORA1PDE5A
SCHEMBL13446203 0.76 ADORA2A (0.45) ADORA2AADORA2BADORA3ADORA1PDE5A

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-1092435-B1 REMEDIES FOR DIABETES KYOWA HAKKO KOGYO KK (JP) 2007-04-04 EP disclosed
US-6489331-B1 A CONDENSED PURINE DERIVATIVE AS AN ACTIVE INGREDIENT AS AN ENHANCER OF INSULIN SECRETION AND A MEDICAMENT FOR THE TREATMENT OF DIABETES KYOWA HAKKO KOGYO CO., LTD. (JP) 2002-12-03 US disclosed
EP-1092435-A1 REMEDIES FOR DIABETES KYOWA HAKKO KOGYO CO., LTD. (JP) 2001-04-18 EP disclosed