Deferoxamine

Deferoxamine

SCHEMBL9351925

CC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCNC(=O)CCC(=O)N(O)CCCCCN.CS(=O)(=O)O.[Mn]

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of Deferoxamine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.97
LMNA P02545 1/20 0.97
GAA P10253 1/20 0.97
SMN1; SMN2 Q16637 1/20 0.97
KDM4A O75164 10/20 0.90
HIF1A Q16665 1/20 0.90
TET2 Q6N021 1/20 0.90
DOHH Q9BU89 1/20 0.90
PAOX Q6QHF9 2/20 0.42
SLC6A5 Q9Y345 2/20 0.40
KDM4C Q9H3R0 9/20 0.37
CASP2 P42575 1/20 0.35
KDM5A P29375 1/20 0.34
KDM7A Q6ZMT4 1/20 0.34
PHF8 Q9UPP1 1/20 0.34
KDM2A Q9Y2K7 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
SCHEMBL30036991 0.99 KDM4E (1.00) KDM4ELMNAGAASMN1; SMN2KDM4A
Deferoxamine SCHEMBL1699778 0.99 KDM4E (1.00) KDM4ELMNAGAASMN1; SMN2KDM4A
Deferoxamine SCHEMBL119982 0.99 KDM4E (1.00) KDM4ELMNAGAASMN1; SMN2KDM4A
Deferoxamine SCHEMBL7715593 0.99 KDM4E (1.00) KDM4ELMNAGAASMN1; SMN2KDM4A
Deferoxamine SCHEMBL3953046 0.97 KDM4E (0.97) KDM4ELMNAGAASMN1; SMN2KDM4A
Deferoxamine SCHEMBL2165915 0.96 KDM4E (0.95) KDM4ELMNAGAASMN1; SMN2KDM4A
Deferoxamine SCHEMBL1034134 0.96 KDM4E (0.95) KDM4ELMNAGAASMN1; SMN2KDM4A
Deferoxamine SCHEMBL9555338 0.95 KDM4E (0.93) KDM4ELMNAGAASMN1; SMN2KDM4A
Deferoxamine SCHEMBL34571 0.95 KDM4A (1.00) KDM4ELMNAGAASMN1; SMN2KDM4A
SCHEMBL21051754 0.95 KDM4A (1.00) KDM4ELMNAGAASMN1; SMN2KDM4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0614376-A1 A METHOD AND FORMULATIONS USEFUL TO IMPROVE THE STUDY OF HUMAN BODY CAVITIES DIBRA S.p.A. (IT) 1994-09-14 EP disclosed
WO-1993010821-A1 A METHOD AND FORMULATIONS USEFUL TO IMPROVE THE STUDY OF HUMAN BODY CAVITIES BRACCO S.P.A. (IT) 1993-06-10 WO disclosed
US-4758422-A Ferrioxamine paramagnetic contrast agents for MR imaging SALUTAR INC. (US) 1988-07-19 US disclosed
EP-0235361-A2 Ferrioxamine paramagnetic contrast agents for MR imaging SALUTAR, INC. (US) 1987-09-09 EP disclosed