NADH

Ligand id: 4487

Name: NADH

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 20
Hydrogen bond donors 8
Rotatable bonds 11
Topological polar surface area 337.24
Molecular weight 665.12
XLogP -4.99
No. Lipinski's rules broken 3

Molecular properties generated using the CDK

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Similar Ligands
ATP
Targets
GPR17; IP3R1; Kir6.1; P2X1; P2X2; P2X3; P2X4; P2X5; P2X6; P2X7; P2Y11 receptor; P2Y13 receptor; P2Y1 receptor; P2Y2 receptor; P2Y4 receptor... click on ligand to see complete list
(R,S)-PHPNECA
Targets
A1 receptor; A2A receptor; A3 receptor
2-hexynyl-NECA
Targets
A1 receptor; A2A receptor; A2B receptor; A3 receptor
CGS 21680
Targets
A1 receptor; A2A receptor; A2B receptor; A3 receptor
NECA
Targets
A1 receptor; A2A receptor; A2B receptor; A3 receptor
PENECA
Targets
A1 receptor; A2A receptor; A3 receptor
AB-MECA
Targets
A2A receptor; A3 receptor
piclidenoson
Targets
A1 receptor; A2A receptor; A2B receptor; A3 receptor
[3H]CGS 21680
Targets
A2A receptor
[3H]NECA
Targets
A2A receptor; A3 receptor
[125I]AB-MECA
Targets
A3 receptor
Cl-IB-MECA
Targets
A1 receptor; A2A receptor; A2B receptor; A3 receptor
MPC-MECA
Targets
A3 receptor
2',3'-ddATP
Targets
P2Y1 receptor
2MeSADP
Targets
P2Y12 receptor; P2Y13 receptor; P2Y1 receptor
2MeSATP
Targets
P2Y11 receptor; P2Y13 receptor; P2Y1 receptor; P2Y6 receptor
ADP
Targets
P2Y11 receptor; P2Y12 receptor; P2Y13 receptor; P2Y1 receptor; P2Y6 receptor; Peroxisomal membrane protein; SLC25A42; TRPM4; phosphomevalonate kinase
ATPγS
Targets
P2Y11 receptor; P2Y13 receptor; P2Y1 receptor
dATPαS
Targets
P2Y1 receptor
2-chloroadenosine-5-triphosphate
Targets
P2Y1 receptor
A3P5PS
Targets
PAPS transporter 1; PAPS transporter 2
Ap4A
Targets
P2Y12 receptor; P2Y13 receptor; P2Y2 receptor; P2Y4 receptor
ADPβS
Targets
P2Y11 receptor; P2Y12 receptor; P2Y13 receptor; P2Y1 receptor
AR-C67085
Targets
P2Y11 receptor; P2Y12 receptor
BzATP
Targets
P2X1; P2X3; P2X7; P2Y11 receptor
dATP
Targets
P2Y11 receptor
[3H]2MeSADP
Targets
P2Y12 receptor; P2Y1 receptor
INS49266
Targets
P2Y12 receptor
[33P]2MeSADP
Targets
P2Y13 receptor
cangrelor
Targets
GPR17; P2Y12 receptor; P2Y13 receptor
cyclic AMP
Targets
CNGA1; CNGA2; CNGA3; HCN1; HCN2; HCN4; OATP4C1; phosphodiesterase 10A; phosphodiesterase 11A; phosphodiesterase 1C; phosphodiesterase 4D; phosphodiesterase 5A; phosphodiesterase 7A; phosphodiesterase 7B; phosphodiesterase 8B... click on ligand to see complete list
oleoyl-CoA
Targets
Kir2.1
ADP ribose
Targets
TRPM2
NAADP
Targets
P2Y11 receptor; TRPM2
NAD
Targets
P2Y11 receptor; TRPM2
AMP-PNP
Targets
TRPM4
acetyl CoA
Targets
Acetyl-CoA carboxylase 1; Acetyl-CoA carboxylase 2; AcetylCoA transporter; acetyl-CoA acetyltransferase 1; hydroxymethylglutaryl-CoA synthase 1
acetoacetyl CoA
Targets
acetyl-CoA acetyltransferase 1; hydroxymethylglutaryl-CoA synthase 1
(S)-3-hydroxy-3-methylglutaryl-CoA
Targets
hydroxymethylglutaryl-CoA reductase; hydroxymethylglutaryl-CoA synthase 1
NADPH
Targets
hydroxymethylglutaryl-CoA reductase; squalene synthase
coenzyme A
Targets
acetyl-CoA acetyltransferase 1
NADP+
apadenoson
Targets
A1 receptor; A2A receptor; A3 receptor
MRS2365
Targets
P2Y1 receptor
ARL66096
Targets
P2Y12 receptor
[35S]dATPαS
[35S]ADPβS
Targets
P2Y1 receptor
αβ-meATP
Targets
P2X1; P2X3
Ip5I
Targets
P2X1
L-βγ-meATP
Targets
P2X1
[14C]acetylCoA
Targets
AcetylCoA transporter
αβ-methyleneADP
Targets
Ecto-5'-Nucleotidase
[3H]cAMP
Targets
protein kinase A
8-pCPT-2'-O-Me-cAMP
malonyl-CoA
Targets
Malonyl-CoA decarboxylase
methylmalonyl-CoA
N6 benzyl-cAMP
Targets
protein kinase A
propionyl-CoA
Targets
Propionyl-CoA carboxylase
Rp-cAMPS
Targets
protein kinase A
[3H]αβ-meATP
[35S]ATPγS
bucladesine
evodenoson
CP608,039
Targets
A1 receptor; A3 receptor
2-phenylethylyl-adenosine derivative
Targets
A3 receptor
compound 3a [PMID: 22873688]
Targets
P2Y1 receptor
[3H]PSB-0413
Targets
P2Y12 receptor
compound 4 [PMID: 23083103]
Targets
P2Y12 receptor
OAADPR
Targets
TRPM2
palmitoyl-CoA
mipomersen
UK-432,097
Targets
A2A receptor
2-Cl-ADP(α-BH3)
Targets
P2Y1 receptor
compound 48 [PMID: 25815140]
Targets
Sodium/nucleoside cotransporter 2
volanesorsen
ARL 67156
Targets
ectonucleoside triphosphate diphosphohydrolase 1
2'3'-cGAMP
Targets
stimulator of interferon response cGAMP interactor 1
nusinersen
ADU-S100
Targets
stimulator of interferon response cGAMP interactor 1