Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL28297788

COC(=O)CN(Cl)c1ccccc1.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.38

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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 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
MAPK1 P28482 1/20 0.38
NR1I2 O75469 1/20 0.38
POLB P06746 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
PTPN1 P18031 1/20 0.36
PTPN6 P29350 1/20 0.36
PTPN11 Q06124 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KCNA5 P22460 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
TSHR P16473 1/20 0.35
MAOB P27338 1/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA4 P43681 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
SCHEMBL5792243 0.91 POLB (0.43) ALDH1A1MAPK1NR1I2POLBLMNA
Cadaverine Tartrate SCHEMBL27762982 0.82 ALDH1A1 (0.38) ALDH1A1MAPK1NR1I2POLBSMN1; SMN2
SCHEMBL29067561 0.77 ALDH1A1 (0.42) ALDH1A1POLBSMN1; SMN2LMNATP53
SCHEMBL28156316 0.76 TSHR (0.53) ALDH1A1SMN1; SMN2LMNATP53L3MBTL1
SCHEMBL28332035 0.74 SMN1; SMN2 (0.54) ALDH1A1POLBSMN1; SMN2GAAMAPT
SCHEMBL2728438 0.74 ALDH1A1 (0.47) ALDH1A1POLBSMN1; SMN2LMNATP53
SCHEMBL8627738 0.73 POLB (0.46) ALDH1A1MAPK1NR1I2POLBLMNA
SCHEMBL7437555 0.73 MTNR1A (0.49) ALDH1A1MAPK1NR1I2POLBLMNA
SCHEMBL7365805 0.73 NR1H2 (0.47) ALDH1A1MAPK1NR1I2SMN1; SMN2KCNA5
SCHEMBL3841166 0.72 TDP1 (0.44) ALDH1A1MAPK1NR1I2POLBSMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109867684-A A kind of preparation method of II type bisulfate clopidogrel 武汉武药制药有限公司 2019-06-11 CN disclosed