acompound

Showing entry for Phorbol 12,13-Dibutyrate

General Compound Information
BXGC Id	BXGC0022307
Compound Name	Phorbol 12,13-Dibutyrate
Structure
Formula	C28H40O8
InchiKey	BQJRUJTZSGYBEZ-YVQNUNKESA-N
SMILES	CCCC(=O)O[C@@H]1[C@@H](C)[C@@]2(O)[C@H]([C@H]3[C@]1(OC(=O)CCC)C3(C)C)C=C(C[C@]1([C@H]2C=C(C1=O)C)O)CO
Inchi	InChI=1S/C28H40O8/c1-7-9-20(30)35-24-16(4)27(34)18(22-25(5,6)28(22,24)36-21(31)10-8-2)12-17(14-29)13-26(33)19(27)11-15(3)23(26)32/h11-12,16,18-19,22,24,29,33-34H,7-10,13-14H2,1-6H3/t16-,18+,19-,22-,24-,26-,27-,28-/m1/s1
IUPAC
Molecular Weight	504.27
Pubchem Id	37783
Chembl Id	CHEMBL27768

Targets of Information Source

DrugBank

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Groups	Target Type

PDB

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	Ka M-1

Binding DB

n.a

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Ki nM	ic50 nM	Kd nM	EC50 nM

CHEMBL

CHEMBL27768

Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	width="10%">Type	Relation	value	Units
Uniport Id	BXGT Id	Protein Name	Status	Protein Class	Gene	Type	Relation	value	Units
P05129	BXGT006322	Protein kinase C gamma type	reviewed	Kinase	PRKCG	Kd	'>'	65	nM
Q02156	BXGT012639	Protein kinase C epsilon type	reviewed	Kinase	PRKCE	Kd	'='	1	nM
P24723	BXGT008989	Protein kinase C eta type	reviewed	Kinase	PRKCH	Kd	'='	0	nM
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Kd	'='	0	nM
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Ki	'='	0	nM
P23298	BXGT008849	Protein kinase C eta type	reviewed	-	Prkch	Ki	'='	0	nM
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Ki	-	-	-
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Relative binding affinity	'='	1	-
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ki	'='	210	nM
Q96QE3	BXGT019718	ATPase family AAA domain-containing protein 5	reviewed	-	ATAD5	Potency	-	39	nM
Q02156	BXGT012639	Protein kinase C epsilon type	reviewed	Kinase	PRKCE	Kd	'='	5	nM
P24723	BXGT008989	Protein kinase C eta type	reviewed	Kinase	PRKCH	Kd	'='	4	nM
P24723	BXGT008989	Protein kinase C eta type	reviewed	Kinase	PRKCH	Kd	'='	0	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ratio	'>'	1000	-
P81908	BXGT011959	Cholinesterase	reviewed	-	BCHE	Inhibition	'='	0	%
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Ki	'='	21	nM
P27695	BXGT009199	DNA-(apurinic or apyrimidinic site) lyase	reviewed	-	APEX1	Potency	-	12	nM
P05771	BXGT006384	Protein kinase C beta type	reviewed	Kinase	PRKCB	Kd	'='	1	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Inhibition	-	-	-
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ki	'='	14	nM
Q92830	BXGT019379	Histone acetyltransferase KAT2A	reviewed	-	KAT2A	Potency	-	19952	nM
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Kd	'='	51	nM
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Ki	'='	0	nM
P63319	BXGT011518	Protein kinase C gamma type	reviewed	-	Prkcg	Ki	'='	52	nM
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Kd	'='	272	nM
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Kd	'='	7	nM
P05771	BXGT006384	Protein kinase C beta type	reviewed	Kinase	PRKCB	Kd	'='	1	nM
P05129	BXGT006322	Protein kinase C gamma type	reviewed	Kinase	PRKCG	Kd	'='	1	nM
P05771	BXGT006384	Protein kinase C beta type	reviewed	Kinase	PRKCB	Kd	'='	1	nM
Q04759	BXGT012781	Protein kinase C theta type	reviewed	Kinase	PRKCQ	Kd	'>'	200	nM
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Kd	'='	46	nM
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Relative binding affinity	'>'	10000	-
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Ki	'='	12	nM
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Ratio	'='	27	-
Q04759	BXGT012781	Protein kinase C theta type	reviewed	Kinase	PRKCQ	Kd	'='	0	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ratio	'='	598	-
Q02156	BXGT012639	Protein kinase C epsilon type	reviewed	Kinase	PRKCE	Kd	'='	0	nM
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Ki	'='	1	nM
P05771	BXGT006384	Protein kinase C beta type	reviewed	Kinase	PRKCB	Ki	'='	1	nM
P05129	BXGT006322	Protein kinase C gamma type	reviewed	Kinase	PRKCG	Kd	'='	1	nM
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Ki	'='	0	nM
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Ratio	'='	125	-
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ki	'='	1	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ratio	'='	3	-
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ki	'='	6	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Kd	'='	0	nM
Q96QE3	BXGT019718	ATPase family AAA domain-containing protein 5	reviewed	-	ATAD5	Potency	-	99	nM
P05129	BXGT006322	Protein kinase C gamma type	reviewed	Kinase	PRKCG	Ki	'='	2	nM
O42275	BXGT004559	Acetylcholinesterase	reviewed	-	ache	Inhibition	'='	19	%
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ratio	'='	40	-
Q04759	BXGT012781	Protein kinase C theta type	reviewed	Kinase	PRKCQ	Kd	'='	3	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ki	'='	19	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Kd	'='	2	nM
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Kd	'='	1	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ratio	'='	52	-
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ratio	'='	31	-
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Kd	'='	1	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ratio	'='	2	-
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Kd	'='	1	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ratio	'='	15	-
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ki	'='	0	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ki	'='	25	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ki	'='	18	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ki	'='	0	nM
P04409	BXGT006208	Protein kinase C alpha type	reviewed	-	PRKCA	Ki	'='	0	nM
Q02156	BXGT012639	Protein kinase C epsilon type	reviewed	Kinase	PRKCE	Ki	'='	14	nM
P24723	BXGT008989	Protein kinase C eta type	reviewed	Kinase	PRKCH	Ki	'='	10	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Kd	'='	383	nM
P05129	BXGT006322	Protein kinase C gamma type	reviewed	Kinase	PRKCG	Kd	'>'	16	nM
P05771	BXGT006384	Protein kinase C beta type	reviewed	Kinase	PRKCB	Ki	'='	1	nM
Q02156	BXGT012639	Protein kinase C epsilon type	reviewed	Kinase	PRKCE	Ki	'='	1	nM
P05129	BXGT006322	Protein kinase C gamma type	reviewed	Kinase	PRKCG	Ki	'='	1	nM
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Ki	'='	107	nM
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Kd	'='	0	nM
Q8IV61	BXGT018340	Ras guanyl-releasing protein 3	reviewed	Enzyme modulator	RASGRP3	Activity	-	-	-
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	ED50	'='	0	uM
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Kd	'='	0	nM
P15498	BXGT008133	Proto-oncogene vav	reviewed	-	VAV1	Kd	'='	1	nM
Q9EPK8	BXGT020290	Transient receptor potential cation channel subfamily V member 4	reviewed	-	Trpv4	EC50	'='	22470	nM
Q02156	BXGT012639	Protein kinase C epsilon type	reviewed	Kinase	PRKCE	Kd	'='	0	nM
P24723	BXGT008989	Protein kinase C eta type	reviewed	Kinase	PRKCH	Ki	'='	0	nM
Q04759	BXGT012781	Protein kinase C theta type	reviewed	Kinase	PRKCQ	Ki	'='	1	nM
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Ki	'='	100	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ki	'='	0	nM
P28867	BXGT009299	Protein kinase C delta type	reviewed	-	Prkcd	Ki	'='	6	nM
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Ki	'='	17	nM
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Ki	'='	1	nM
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Activity	-	-	-
P81908	BXGT011959	Cholinesterase	reviewed	-	BCHE	Inhibition	'='	5	%
P17252	BXGT008294	Protein kinase C alpha type	reviewed	Kinase	PRKCA	Kd	'='	1	nM
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Kd	'='	0	nM
Q02156	BXGT012639	Protein kinase C epsilon type	reviewed	Kinase	PRKCE	Kd	'='	0	nM
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Ratio	'='	15	-
Q05655	BXGT012832	Protein kinase C delta type	reviewed	Kinase	PRKCD	Activity	-	-	-
O42275	BXGT004559	Acetylcholinesterase	reviewed	-	ache	Inhibition	'='	22	%
Q96QE3	BXGT019718	ATPase family AAA domain-containing protein 5	reviewed	-	ATAD5	Potency	-	315	nM
Q02156	BXGT012639	Protein kinase C epsilon type	reviewed	Kinase	PRKCE	Activity	-	-	-

Foods containing the compound

Foods

BXGF Id	Food Name	Scientific Name	Food Group
BXGF Id	Food Name	Scientific Name	Food Group
BXGF04915	Croton tiglium	Croton tiglium	Medicinal Plant

The compound-realted diseases

Diseases

BXGD Id	Disease Name	CUI Disease Id	Disease Class Name	Number of targets^{?Number of targets related to compound connecting disease, higher numbers indicate the compound is more associated with the disease}