Ligand Id: 4124
Ligand name adenophostin A

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 23
Hydrogen bond donors 10
Rotatable bonds 11
Topological polar surface area 387.71
Molecular weight 669.05
XLogP -8.75
No. Lipinski's rules broken 3

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands

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Similar Ligands
cordycepin
GRAC targets
Equilibrative nucleoside transporter 3
2'-deoxyadenosine
GRAC targets
Adenosine deaminase
IUPHAR-DB targets
Adenosine deaminase
adenosine
GRAC targets
Adenosine deaminase; Adenosine kinase; CNT1; CNT2; CNT3; Equilibrative nucleoside transporter 1; Equilibrative nucleoside transporter 2; Equilibrative nucleoside transporter 3; TRPM4
IUPHAR-DB targets
A1 receptor; A2A receptor; A2B receptor; A3 receptor; Adenosine deaminase; Adenosine kinase
vidarabine
GRAC targets
CNT2; Equilibrative nucleoside transporter 1; Equilibrative nucleoside transporter 2
[14C]adenosine
GRAC targets
Equilibrative nucleoside transporter 1; Equilibrative nucleoside transporter 2
2',5'-dideoxyadenosine
5'-dAMP
GRAC targets
Ecto-5'-Nucleotidase
IUPHAR-DB targets
Ecto-5'-Nucleotidase
NECA
IUPHAR-DB targets
A1 receptor; A2A receptor; A2B receptor; A3 receptor
[3H]NECA
IUPHAR-DB targets
A2A receptor; A3 receptor
AMA
GRAC targets
Histidine decarboxylase
AMP
GRAC targets
AMP kinase; Ecto-5'-Nucleotidase; Peroxisomal membrane protein; TRPM4
IUPHAR-DB targets
AMP kinase; Ecto-5'-Nucleotidase; TRPM4
5'-deoxyadenosyl-(3-aminopropyl) methylsulfonium
Ap3a
dATP
IUPHAR-DB targets
P2Y11 receptor
Ap4A
GRAC targets
P2Y2 receptor
IUPHAR-DB targets
P2Y13 receptor; P2Y2 receptor; P2Y4 receptor
adenosine-3'-5'-diphosphate
IUPHAR-DB targets
P2Y1 receptor
αβ-methyleneADP
GRAC targets
Ecto-5'-Nucleotidase
ADP
GRAC targets
P2Y12 receptor; P2Y13 receptor; P2Y1 receptor; Peroxisomal membrane protein; SLC25A42; TRPM4
IUPHAR-DB targets
P2Y12 receptor; P2Y13 receptor; P2Y1 receptor; P2Y6 receptor; TRPM4; phosphomevalonate kinase
2',3'-ddATP
IUPHAR-DB targets
P2Y1 receptor
A2P5P
IUPHAR-DB targets
P2Y1 receptor
[35S]ADPβS
GRAC targets
P2Y1 receptor
L-βγ-meATP
GRAC targets
P2X1
S-adenosyl-L-homocysteine
S-adenosylhomocysteine
GRAC targets
S-Adenosylhomocysteine hydrolase
IUPHAR-DB targets
S-Adenosylhomocysteine hydrolase
ATP
GRAC targets
IP3R1; P2Y11 receptor; P2Y12 receptor; P2Y13 receptor; P2Y2 receptor; P2Y4 receptor; P2Y6 receptor; Propionyl-CoA carboxylase ; Pyruvate carboxylase; RyR1; RyR2; RyR3; TRPM4; TRPM5; Vesicular nucleotide transporter... click on ligand to see complete list
IUPHAR-DB targets
GPR17; KCa4.2; Kir6.1; Kir6.2; P2Y11 receptor; P2Y12 receptor; P2Y13 receptor; P2Y1 receptor; P2Y2 receptor; P2Y4 receptor; P2Y6 receptor; TRPM4; diphosphomevalonate decarboxylase; mevalonate kinase; phosphomevalonate kinase... click on ligand to see complete list
ADPβS
GRAC targets
P2Y1 receptor
IUPHAR-DB targets
P2Y11 receptor; P2Y12 receptor; P2Y13 receptor; P2Y1 receptor
Ap5a
AMP-PNP
GRAC targets
TRPM4
IUPHAR-DB targets
TRPM4
dATPαS
IUPHAR-DB targets
P2Y1 receptor
[35S]dATPαS
GRAC targets
P2Y1 receptor
αβ-meATP
GRAC targets
P2X1; P2X3
[3H]αβ-meATP
A3P5PS
GRAC targets
PAPS transporter 1; PAPS transporter 2
IUPHAR-DB targets
P2Y1 receptor
[35S]ATPαS
GRAC targets
P2Y1 receptor
ATPγS
IUPHAR-DB targets
P2Y11 receptor; P2Y12 receptor; P2Y13 receptor; P2Y1 receptor
[35S]ATPγS
S-adenosyl methionine
GRAC targets
S-Adenosylmethionine carrier; S-Adenosylmethionine decarboxylase
APPA
IUPHAR-DB targets
GABAB1; GABAB receptor
[33P]2MeSADP
IUPHAR-DB targets
P2Y13 receptor
ADP ribose
GRAC targets
TRPM2
IUPHAR-DB targets
TRPM2
NAD
GRAC targets
P2Y11 receptor
IUPHAR-DB targets
P2Y11 receptor; TRPM2; squalene synthase
NADP+
pentostatin
GRAC targets
Adenosine deaminase; Equilibrative nucleoside transporter 1
NAADP
GRAC targets
P2Y11 receptor
IUPHAR-DB targets
P2Y11 receptor; TRPM2
A134974
GRAC targets
Adenosine kinase