Compile Data Set for Download or QSAR
Report error Found 219 Enz. Inhib. hit(s) with all data for entry = 50037621
TargetNeprilysin(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50175518((3R,7S)-7-((R)-2-Mercapto-3-phenyl-propionylamino)...)
Affinity DataIC50: 0.0800nMAssay Description:Inhibitory concentration against neutral endopeptidaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetType-1 angiotensin II receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50041969(3-{2-Butyl-4-oxo-3-[2'-(2H-tetrazol-5-yl)-biphenyl...)
Affinity DataIC50: 0.100nMAssay Description:Inhibitory concentration against angiotensin II receptor, type 1More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetAngiotensin-converting enzyme(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50175518((3R,7S)-7-((R)-2-Mercapto-3-phenyl-propionylamino)...)
Affinity DataIC50: 0.110nMAssay Description:Inhibitory concentration against angiotensin I converting enzymeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50145347(1-(2-(4-(6-fluoro-1H-indol-3-yl)-5,6-dihydropyridi...)
Affinity DataIC50: 0.110nMAssay Description:Inhibitory concentration against serotonin transporterMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50412114(SB-649915 | CHEMBL183460)
Affinity DataKi:  0.320nMAssay Description:Negative logarithm causing 50% receptor occupancy against 5-hydroxytryptamine 1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetSubstance-P receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50002653(CHEMBL419500 | ((2R,3S)-2-Benzhydryl-1-aza-bicyclo...)
Affinity DataIC50: 0.330nMAssay Description:Inhibitory concentration against tachykinin receptor 1More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50048803(5-[2-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-et...)
Affinity DataIC50: 0.420nMAssay Description:Inhibitory concentration against 5-hydroxytryptamine 2 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50150105([2-(6-Fluoro-chroman-8-yloxy)-ethyl]-[3-(5-fluoro-...)
Affinity DataKi:  0.5nMAssay Description:Inhibition constant against serotonin transporterMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetBeta-2 adrenergic receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50027185(CHEMBL183921)
Affinity DataKi:  0.630nMAssay Description:Negative logarithm causing 50% receptor occupancy against beta-2 adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetType-2 angiotensin II receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM82433(L-159689 | CHEMBL302102 | N-Pentyl-N-[[2-propyl-3-...)
Affinity DataIC50: 0.700nMAssay Description:Inhibitory concentration against angiotensin II receptor, type 2More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50027185(CHEMBL183921)
Affinity DataKi:  0.790nMAssay Description:Negative logarithm causing 50% receptor occupancy against 5-hydroxytryptamine 1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetType-1 angiotensin II receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50042235(2-butyl-3-{[2'-(1H-tetrazol-5-yl)[1,1'-biphenyl]-4...)
Affinity DataKi:  0.800nMAssay Description:Inhibitory concentration against angiotensin II receptor, type 1More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetType-1 angiotensin II receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50175523(4''-(2-Butyl-4-oxo-1,3-diaza-spiro[4.4]non-1-en-3-...)
Affinity DataKi:  0.800nMAssay Description:Inhibitory concentration against angiotensin II receptor, type 1More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetAlpha-1A/Alpha-1B/Alpha-1D adrenergic receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50109061(3-{1-[2-(1H-Indol-4-yloxy)-ethyl]-1,2,3,6-tetrahyd...)
Affinity DataKi:  1nMAssay Description:Inhibition constant against alpha adrenergic receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetTyrosine-protein kinase ABL1(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM4552(CHEMBL288441 | SKI-606 | 4-[(2,4-Dichloro-5-methox...)
Affinity DataIC50: 1.10nMAssay Description:Inhibitory concentration against v-Abl tyrosine kinaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetAngiotensin-converting enzyme(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50115848((S)-3-(1H-Indol-3-yl)-2-[(R)-3-mercapto-2-((S)-5-m...)
Affinity DataKi:  1.30nMAssay Description:Inhibition constant against angiotensin I converting enzymeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50109061(3-{1-[2-(1H-Indol-4-yloxy)-ethyl]-1,2,3,6-tetrahyd...)
Affinity DataKi:  1.5nMAssay Description:Inhibition constant against serotonin transporterMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetD(4) dopamine receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50092053(2-[4-(4-Chloro-benzyl)-piperazin-1-yl]-1-(2,3-dihy...)
Affinity DataIC50: 1.60nMAssay Description:Inhibitory concentration against dopamine receptor D4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50027184(CHEMBL180700)
Affinity DataKi:  1.60nMAssay Description:Negative logarithm causing 50% receptor occupancy against 5-hydroxytryptamine 1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetType-1 angiotensin II receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM82433(L-159689 | CHEMBL302102 | N-Pentyl-N-[[2-propyl-3-...)
Affinity DataIC50: 1.70nMAssay Description:Inhibitory concentration against angiotensin II receptor, type 1More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetEndothelin-1 receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50117910(4'-(2-Butyl-4-oxo-1,3-diaza-spiro[4.4]non-1-en-3-y...)
Affinity DataKi:  1.90nMAssay Description:Inhibitory concentration against endothelin receptor type AMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetD(4) dopamine receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50119970(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-((R)-2-me...)
Affinity DataIC50: 2nMAssay Description:Inhibitory concentration against dopamine receptor D4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50057128(A-80426 | (2-Benzofuran-6-yl-ethyl)-((R)-5-methoxy...)
Affinity DataKi:  2nMAssay Description:Inhibition constant against 5-hydroxytryptamine 1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50175501(3-Chloro-7-{2-[(R)-4-(6-fluoro-naphthalen-1-yl)-2-...)
Affinity DataIC50: 2.10nMAssay Description:Inhibitory concentration against serotonin transporterMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetSubstance-K receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50175505(1-{2-[1-Benzoyl-3-((S)-3,4-dichloro-phenyl)-pyrrol...)
Affinity DataIC50: 2.30nMAssay Description:Inhibitory concentration against tachykinin receptor 2More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetHistamine H1 receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50175494(1-{2-[(R)-3-(3,4-Dichloro-phenyl)-1-(3,4,5-trimeth...)
Affinity DataIC50: 3nMAssay Description:Inhibition constant against histamine H1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetD(4) dopamine receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50119892(2-[4-(4-Methyl-benzyl)-piperazin-1-yl]-1-(2-methyl...)
Affinity DataIC50: 3nMAssay Description:Inhibitory concentration against dopamine receptor D4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetPolyunsaturated fatty acid 5-lipoxygenase(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50110484(3-[3-Fluoro-5-(4-methoxy-tetrahydro-pyran-4-yl)-ph...)
Affinity DataIC50: 3nMAssay Description:Inhibition constant against arachidonate 5-lipoxygenase More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetSubstance-P receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50175522(CHEMBL372587 | MDL 105,212 (R)-enantiomer | 1-{2-[...)
Affinity DataIC50: 3.10nMAssay Description:Inhibitory concentration against tachykinin receptor 1More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50175525([2-(3-Fluoro-phenyl)-ethyl]-(5-methoxy-1,2,3,4-tet...)
Affinity DataKi:  3.20nMAssay Description:Inhibition constant against 5-hydroxytryptamine 1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetProto-oncogene tyrosine-protein kinase Src(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM4552(CHEMBL288441 | SKI-606 | 4-[(2,4-Dichloro-5-methox...)
Affinity DataIC50: 3.80nMAssay Description:Inhibitory concentration against Src kinaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetHistamine H1 receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50036935(8-Chloro-11-[1-(5-methyl-pyridin-3-ylmethyl)-piper...)
Affinity DataIC50: 3.90nMAssay Description:Inhibition constant against histamine H1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetThromboxane-A synthase(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50043841((E)-6-{4-[2-(4-Chloro-benzenesulfonylamino)-ethyl]...)
Affinity DataIC50: 4nMAssay Description:Inhibitory concentration against thromboxane A2 synthaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetGastrin/cholecystokinin type B receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM81962(S-L-365,260)
Affinity DataIC50: 4nMAssay Description:Inhibitory concentration against gastrin receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM84745(DULOXETINE | LY-248686 | CAS_136434-34-9 | LY24868...)
Affinity DataKi:  4.60nMAssay Description:Inhibition constant against serotonin transporterMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50145347(1-(2-(4-(6-fluoro-1H-indol-3-yl)-5,6-dihydropyridi...)
Affinity DataKi:  4.70nMAssay Description:Inhibition constant against dopamine receptor D2More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50007559(CHEMBL54786 | 5-[2-(4-Naphthalen-1-yl-piperazin-1-...)
Affinity DataIC50: 5nMAssay Description:Inhibitory concentration against 5-hydroxytryptamine 1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50048803(5-[2-(4-Benzo[d]isothiazol-3-yl-piperazin-1-yl)-et...)
Affinity DataIC50: 5nMAssay Description:Inhibition constant against dopamine receptor D2More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetAngiotensin-converting enzyme(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50175519((4S,5R)-5-((S)-2-Mercapto-3-phenyl-propionylamino)...)
Affinity DataIC50: 5nMAssay Description:Inhibitory concentration against angiotensin I converting enzymeMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50108392((3-ENDO)-8-METHYL-8-AZABICYCLO[3.2.1]OCT-3-YL 1H-I...)
Affinity DataKi:  5.30nMAssay Description:Inhibition constant against 5-hydroxytryptamine 1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50175503(Dimethyl-carbamic acid (R)-2-methyl-1-[2-(4-nitro-...)
Affinity DataIC50: 6nMAssay Description:Inhibitory concentration against serotonin transporterMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50412114(SB-649915 | CHEMBL183460)
Affinity DataKi:  6.30nMAssay Description:Negative logarithm causing 50% receptor occupancy against serotonin transporterMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50057093((2-Benzo[1,3]dioxol-5-yl-ethyl)-(5-methoxy-1,2,3,4...)
Affinity DataKi:  6.70nMAssay Description:Inhibition constant against 5-hydroxytryptamine 1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetNeuronal acetylcholine receptor subunit alpha-7(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50108392((3-ENDO)-8-METHYL-8-AZABICYCLO[3.2.1]OCT-3-YL 1H-I...)
Affinity DataKi:  6.90nMAssay Description:Inhibition constant against nicotinic acetylcholine receptor alpha7More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetHistamine H1 receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50128875([3-(4-Chloro-phenyl)-3-pyridin-2-yl-propyl]-[4-(1H...)
Affinity DataKi:  7nMAssay Description:Inhibition constant against histamine H1 receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetNeprilysin(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50175519((4S,5R)-5-((S)-2-Mercapto-3-phenyl-propionylamino)...)
Affinity DataIC50: 8nMAssay Description:Inhibitory concentration against neutral endopeptidaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50082412(1-phenyl-3-spiro[1,3-dihydrobenzo[e]isobenzofuran-...)
Affinity DataKi:  8.30nMAssay Description:Inhibition constant against 5-hydroxytryptamine 1A receptorMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetSubstance-K receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50175522(CHEMBL372587 | MDL 105,212 (R)-enantiomer | 1-{2-[...)
Affinity DataIC50: 8.40nMAssay Description:Inhibitory concentration against tachykinin receptor 2More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetD(2) dopamine receptor(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50001884(8-Chloro-11-(4-methyl-piperazin-1-yl)-5H-dibenzo[b...)
Affinity DataIC50: 9nMAssay Description:Inhibition constant against dopamine receptor D2More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
TargetSodium-dependent serotonin transporter(Human)
Organon Laboratories

Curated by ChEMBL
LigandPNGBDBM50132686(Dimethyl-((2S,3S)-3-naphthalen-2-yl-bicyclo[2.2.1]...)
Affinity DataIC50: 9nMAssay Description:Inhibitory concentration against serotonin transporterMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/4/2012
Entry Details Article
PubMed
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