PCIDB

KNApSAcK Metabolite C00038685

Metabolite

KNApSAcK Entry

id C00038685
Name Calyculin A
CAS RN 101932-71-2
Standard InChI InChI=1S/C50H81N4O15P/c1-29(20-22-51)16-14-17-30(2)32(4)24-33(5)42(57)35(7)38(55)25-41(65-13)45-46(69-70(61,62)63)49(8,9)50(68-45)26-39(56)34(6)40(67-50)19-15-18-36-27-66-48(53-36)31(3)21-23-52-47(60)44(59)43(58)37(28-64-12)54(10)11/h14-18,20,24,27,31,33-35,37-46,55-59H,19,21,23,25-26,28H2,1-13H3,(H,52,60)(H2,61,62,63)/b16-14+,18-15+,29-20-,30-17+,32-24+/t31-,33+,34-,35-,37-,38-,39+,40-,41-,42+,43-,44-,45+,46-,50+/m0/s1
Standard InChI (Main Layer) InChI=1S/C50H81N4O15P/c1-29(20-22-51)16-14-17-30(2)32(4)24-33(5)42(57)35(7)38(55)25-41(65-13)45-46(69-70(61,62)63)49(8,9)50(68-45)26-39(56)34(6)40(67-50)19-15-18-36-27-66-48(53-36)31(3)21-23-52-47(60)44(59)43(58)37(28-64-12)54(10)11/h14-18,20,24,27,31,33-35,37-46,55-59H,19,21,23,25-26,28H2,1-13H3,(H,52,60)(H2,61,62,63)

Cluster

Phytochemical cluster
KCF-S cluster No. 349

Link

ChEMBL

By standard InChI CHEMBL430266
By standard InChI Main Layer CHEMBL430266 CHEMBL487898 CHEMBL446220 CHEMBL452909 CHEMBL1482114 CHEMBL1994203

KEGG

By LinkDB C05370

CTD

By CAS RN C059041

Species

Summary

Plant class

class name count

Family

family name count

List (1)

* NCBI
KNApSAcK organism *ID *family *plant class *kingdom
Discodermia calyx

Human Protein / Gene in interaction

7 ChEMBL Protein in interactions

accession description class description compound assay ID (# of activities) # of diseases
(OMIM / KEGG)
P18031 Tyrosine-protein phosphatase non-receptor type 1 Tyr CHEMBL430266 CHEMBL766691 (1) CHEMBL767328 (1)
CHEMBL857419 (1)
0 / 0
Q16637 Survival motor neuron protein Unclassified protein CHEMBL1482114 CHEMBL1613842 (1)
4 / 2
Q15172 Serine/threonine-protein phosphatase 2A 56 kDa regulatory subunit alpha isoform Protein phosphatase regulatory subunit CHEMBL430266 CHEMBL766692 (1)
0 / 0
Q92830 Histone acetyltransferase KAT2A Enzyme CHEMBL1482114 CHEMBL1738606 (1)
0 / 0
P42858 Huntingtin Unclassified protein CHEMBL430266 CHEMBL1614147 (1) CHEMBL1614156 (1)
1 / 1
P36873 Serine/threonine-protein phosphatase PP1-gamma catalytic subunit Ser_Thr CHEMBL430266 CHEMBL799488 (1) CHEMBL799489 (1)
CHEMBL799490 (1) CHEMBL799491 (1)
CHEMBL799492 (1) CHEMBL872988 (1)
CHEMBL799493 (1) CHEMBL799494 (1)
CHEMBL799495 (1) CHEMBL798973 (1)
0 / 0
Q96QE3 ATPase family AAA domain-containing protein 5 Unclassified protein CHEMBL1482114 CHEMBL2114870 (1) CHEMBL2114872 (1)
CHEMBL2114877 (1) CHEMBL2114827 (1)
CHEMBL2114909 (1) CHEMBL2114929 (1)
0 / 0

CTD interaction (19)

compound gene gene name gene description interaction interaction type form reference
pmid
C059041 207 AKT1
AKT
CWS6
PKB
PKB-ALPHA
PRKBA
RAC
RAC-ALPHA
v-akt murine thymoma viral oncogene homolog 1 (EC:2.7.11.1) calyculin A inhibits the reaction [Curcumin results in decreased phosphorylation of AKT1 protein] decreases phosphorylation
/ decreases reaction
protein 18790744
C059041 598 BCL2L1
BCL-XL/S
BCL2L
BCLX
BCLXL
BCLXS
Bcl-X
PPP1R52
bcl-xL
bcl-xS
BCL2-like 1 calyculin A inhibits the reaction [[Ibuprofen co-treated with epigallocatechin gallate] results in decreased expression of BCL2L1 mRNA alternative form] affects cotreatment
/ decreases expression
/ decreases reaction
mRNA 18348186
C059041 598 BCL2L1
BCL-XL/S
BCL2L
BCLX
BCLXL
BCLXS
Bcl-X
PPP1R52
bcl-xL
bcl-xS
BCL2-like 1 calyculin A inhibits the reaction [[Ibuprofen co-treated with epigallocatechin gallate] results in increased expression of BCL2L1 mRNA alternative form] affects cotreatment
/ decreases reaction
/ increases expression
mRNA 18348186
C059041 846 CASR
CAR
EIG8
FHH
FIH
GPRC2A
HHC
HHC1
HYPOC1
NSHPT
PCAR1
calcium-sensing receptor calyculin A promotes the reaction [phorbolol myristate acetate results in increased phosphorylation of CASR protein] increases phosphorylation
/ increases reaction
protein 17376781
C059041 595 CCND1
BCL1
D11S287E
PRAD1
U21B31
cyclin D1 calyculin A inhibits the reaction [Curcumin results in decreased expression of CCND1 protein] decreases expression
/ decreases reaction
protein 18790744
C059041 1499 CTNNB1
CTNNB
MRD19
armadillo
catenin (cadherin-associated protein), beta 1, 88kDa calyculin A results in increased phosphorylation of CTNNB1 protein increases phosphorylation
protein 12813129
16878161
C059041 1545 CYP1B1
CP1B
CYPIB1
GLC3A
P4501B1
cytochrome P450, family 1, subfamily B, polypeptide 1 (EC:1.14.14.1) calyculin A promotes the reaction [Tetrachlorodibenzodioxin results in increased expression of CYP1B1 mRNA] increases expression
/ increases reaction
mRNA 10696073
C059041 1978 EIF4EBP1
4E-BP1
4EBP1
BP-1
PHAS-I
eukaryotic translation initiation factor 4E binding protein 1 calyculin A inhibits the reaction [Curcumin results in decreased phosphorylation of EIF4EBP1 protein] decreases phosphorylation
/ decreases reaction
protein 18790744
C059041 2353 FOS
AP-1
C-FOS
p55
FBJ murine osteosarcoma viral oncogene homolog calyculin A results in increased expression of FOS mRNA increases expression
mRNA 7963561
C059041 3936 LCP1
CP64
L-PLASTIN
LC64P
LPL
PLS2
lymphocyte cytosolic protein 1 (L-plastin) calyculin A results in increased phosphorylation of LCP1 protein increases phosphorylation
protein 14769871
C059041 3936 LCP1
CP64
L-PLASTIN
LC64P
LPL
PLS2
lymphocyte cytosolic protein 1 (L-plastin) KT 5926 inhibits the reaction [calyculin A results in increased phosphorylation of LCP1 protein] decreases reaction
/ increases phosphorylation
protein 14769871
C059041 4170 MCL1
BCL2L3
EAT
MCL1-ES
MCL1L
MCL1S
Mcl-1
TM
bcl2-L-3
mcl1/EAT
myeloid cell leukemia sequence 1 (BCL2-related) calyculin A inhibits the reaction [[Ibuprofen co-treated with epigallocatechin gallate] results in decreased expression of MCL1 mRNA alternative form] affects cotreatment
/ decreases expression
/ decreases reaction
mRNA 18348186
C059041 4170 MCL1
BCL2L3
EAT
MCL1-ES
MCL1L
MCL1S
Mcl-1
TM
bcl2-L-3
mcl1/EAT
myeloid cell leukemia sequence 1 (BCL2-related) calyculin A inhibits the reaction [[Ibuprofen co-treated with epigallocatechin gallate] results in increased expression of MCL1 mRNA alternative form] affects cotreatment
/ decreases reaction
/ increases expression
mRNA 18348186
C059041 3651 PDX1
GSF
IDX-1
IPF1
IUF1
MODY4
PDX-1
STF-1
pancreatic and duodenal homeobox 1 calyculin A inhibits the reaction [Glucose affects the localization of PDX1 protein] affects localization
/ decreases reaction
protein 11574405
C059041 5925 RB1
OSRC
RB
p105-Rb
pRb
pp110
retinoblastoma 1 calyculin A inhibits the reaction [Hydrogen Peroxide results in decreased phosphorylation of RB1 protein] decreases phosphorylation
/ decreases reaction
protein 12621062
C059041 5933 RBL1
CP107
PRB1
p107
retinoblastoma-like 1 (p107) calyculin A inhibits the reaction [Hydrogen Peroxide results in decreased phosphorylation of RBL1 protein] decreases phosphorylation
/ decreases reaction
protein 12621062
C059041 5934 RBL2
P130
Rb2
retinoblastoma-like 2 (p130) calyculin A inhibits the reaction [Hydrogen Peroxide results in decreased phosphorylation of RBL2 protein] decreases phosphorylation
/ decreases reaction
protein 12621062
C059041 5970 RELA
NFKB3
p65
v-rel avian reticuloendotheliosis viral oncogene homolog A calyculin A inhibits the reaction [Cytarabine results in decreased activity of RELA protein] decreases activity
/ decreases reaction
protein 12853972
C059041 6194 RPS6
S6
ribosomal protein S6 calyculin A inhibits the reaction [Curcumin results in decreased phosphorylation of RPS6 protein] decreases phosphorylation
/ decreases reaction
protein 18790744

Related Disease

Diseases related to proteins in ChEMBL interactions

OMIM (5)

OMIM preferred title UniProt
#143100 Huntington disease; hd P42858
#253300 Spinal muscular atrophy, type i; sma1 Q16637
#253550 Spinal muscular atrophy, type ii; sma2 Q16637
#253400 Spinal muscular atrophy, type iii; sma3 Q16637
#271150 Spinal muscular atrophy, type iv; sma4 Q16637

KEGG DISEASE (2)

KEGG disease name UniProt
H00059 Huntington's disease (HD) P42858 (related)
H00455 Spinal muscular atrophy (SMA) Q16637 (related)
Q16637 (related)