Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL5226308

CCCN1C(=O)N2C[C@H](CC)N=C2c2[nH]c(C3CCCC3)nc21.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.37

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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
ADORA2B P29275 4/20 0.35
ADORA3 P0DMS8 3/20 0.35
ADORA1 P30542 3/20 0.35
ADORA2A P29274 3/20 0.35
MEN1 O00255 1/20 0.35
GMNN O75496 1/20 0.35
LMNA P02545 1/20 0.35
CYP1A2 P05177 1/20 0.35
TSHR P16473 1/20 0.35
PMP22 Q01453 1/20 0.35
KMT2A Q03164 1/20 0.35
HIF1A Q16665 1/20 0.35

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 SCHEMBL5227986 1.00 ADORA2B (0.35) ADORA2BADORA3ADORA1ADORA2AMEN1
Cadaverine Tartrate SCHEMBL5226310 0.92 ADORA1 (0.34) ADORA2BADORA3ADORA1ADORA2AMEN1
SCHEMBL8126708 0.92 ADORA2B (0.41) ADORA2BADORA3ADORA1ADORA2AMEN1
Cadaverine Tartrate SCHEMBL6095435 0.88 PDE5A (0.34) ADORA2BADORA3ADORA1ADORA2AMEN1
Cadaverine Tartrate SCHEMBL6092703 0.86 PDE5A (0.36) ADORA2BADORA3ADORA2A
SCHEMBL8126103 0.85 ADORA1 (0.40) ADORA2BADORA3ADORA1ADORA2AMEN1
Hydrochloric Acid SCHEMBL6094663 0.83 ADORA1 (0.39) ADORA2BADORA3ADORA1ADORA2AMEN1
Hydrochloric Acid SCHEMBL6095290 0.83 ADORA1 (0.39) ADORA2BADORA3ADORA1ADORA2AMEN1
Hydrochloric Acid SCHEMBL5233383 0.82 ADORA1 (0.38) ADORA2BADORA3ADORA1ADORA2AMEN1
Hydrochloric Acid SCHEMBL5231804 0.81 ADORA1 (0.39) ADORA2BADORA3ADORA1ADORA2AMEN1

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