Cadaverine Tartrate

Cadaverine Tartrate

SCHEMBL28147371

N#Cc1cccc2cc[nH]c12.O=C(O)C(O)C(O)C(=O)O

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

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
▸ KEAP1 Q14145 1/20 0.47
▸ PDPK1 O15530 1/20 0.43
▸ BACE1 P56817 1/20 0.38
▸ BCHE P06276 4/20 0.38
▸ AHR P35869 1/20 0.38
▸ IKBKB O14920 1/20 0.37
▸ CHUK O15111 1/20 0.37
▸ MCL1 Q07820 1/20 0.37
▸ GRM5 P41594 1/20 0.36
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ BRD4 O60885 1/20 0.34
▸ TAF1 P21675 1/20 0.34
▸ BRPF1 P55201 1/20 0.34
▸ CREBBP Q92793 1/20 0.34
▸ CECR2 Q9BXF3 1/20 0.34
▸ BRD9 Q9H8M2 1/20 0.34
▸ NR3C1 P04150 1/20 0.34
▸ PGR P06401 1/20 0.34
▸ NR3C2 P08235 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 SCHEMBL27875442 0.87 ALDH1A1 (0.38) KEAP1PDPK1GRM5
SCHEMBL29361477 0.84 AHR (0.50) KEAP1PDPK1BACE1AHRMCL1
SCHEMBL1420318 0.84 AHR (0.50) KEAP1PDPK1BACE1AHRMCL1
Trifluoroacetic Acid SCHEMBL29364273 0.82 KEAP1 (0.47) KEAP1PDPK1BACE1BCHEAHR
Hydrochloric Acid SCHEMBL29363603 0.82 AHR (0.48) KEAP1PDPK1BACE1AHRMCL1
Hydrochloric Acid SCHEMBL27757229 0.82 AHR (0.48) KEAP1PDPK1BACE1AHRMCL1
Hydrochloric Acid SCHEMBL3826755 0.82 AHR (0.48) KEAP1PDPK1BACE1AHRMCL1
Formic Acid SCHEMBL30673625 0.81 KEAP1 (0.45) KEAP1PDPK1BACE1BCHEAHR
Cadaverine Tartrate SCHEMBL8591738 0.75 PDPK1 (0.79) KEAP1PDPK1IKBKBCHUKGRM5
Cadaverine Tartrate SCHEMBL21806572 0.73 AHR (0.63) KEAP1AHRCA1CA2

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
CN-106995399-A A kind of method for preparing Silodosin 北京天泰恒华医药技术有限公司 2017-08-01 — — CN disclosed
CN-106995399-A A kind of method for preparing Silodosin 北京天泰恒华医药技术有限公司 2017-08-01 — — CN disclosed
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