BDBM50051194 (3-{[3-(1H-Imidazol-4-yl)-propoxycarbonylamino]-methyl}-benzyl)-carbamic acid 3-(1H-imidazol-4-yl)-propyl ester::CHEMBL415989

SMILES O=C(NCc1cccc(CNC(=O)OCCCc2cnc[nH]2)c1)OCCCc1cnc[nH]1

InChI Key InChIKey=ANTZCCLUSVYIOC-UHFFFAOYSA-N

Data  4 KI

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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50051194   

TargetHistamine H3 receptor(Rattus norvegicus (rat))
Freie Universität Berlin

Curated by ChEMBL
LigandPNGBDBM50051194((3-{[3-(1H-Imidazol-4-yl)-propoxycarbonylamino]-me...)
Show SMILES O=C(NCc1cccc(CNC(=O)OCCCc2cnc[nH]2)c1)OCCCc1cnc[nH]1
Show InChI InChI=1S/C22H28N6O4/c29-21(31-8-2-6-19-13-23-15-27-19)25-11-17-4-1-5-18(10-17)12-26-22(30)32-9-3-7-20-14-24-16-28-20/h1,4-5,10,13-16H,2-3,6-9,11-12H2,(H,23,27)(H,24,28)(H,25,29)(H,26,30)
Affinity DataKi:  50nMAssay Description:In vitro antagonistic activity of the compound against Histamine H3 receptor on Synaptosomes of rat cerebral cortex.More data for this Ligand-Target Pair
TargetHistamine H3 receptor(Rattus norvegicus (rat))
Freie Universität Berlin

Curated by ChEMBL
LigandPNGBDBM50051194((3-{[3-(1H-Imidazol-4-yl)-propoxycarbonylamino]-me...)
Show SMILES O=C(NCc1cccc(CNC(=O)OCCCc2cnc[nH]2)c1)OCCCc1cnc[nH]1
Show InChI InChI=1S/C22H28N6O4/c29-21(31-8-2-6-19-13-23-15-27-19)25-11-17-4-1-5-18(10-17)12-26-22(30)32-9-3-7-20-14-24-16-28-20/h1,4-5,10,13-16H,2-3,6-9,11-12H2,(H,23,27)(H,24,28)(H,25,29)(H,26,30)
Affinity DataKi:  50.1nMAssay Description:Binding affinity against Histamine H3 receptor on Synaptosomes from rat cerebral cortex was evaluatedMore data for this Ligand-Target Pair
TargetHistamine H2 receptor(Cavia porcellus (domestic guinea pig))
Freie Universität Berlin

Curated by ChEMBL
LigandPNGBDBM50051194((3-{[3-(1H-Imidazol-4-yl)-propoxycarbonylamino]-me...)
Show SMILES O=C(NCc1cccc(CNC(=O)OCCCc2cnc[nH]2)c1)OCCCc1cnc[nH]1
Show InChI InChI=1S/C22H28N6O4/c29-21(31-8-2-6-19-13-23-15-27-19)25-11-17-4-1-5-18(10-17)12-26-22(30)32-9-3-7-20-14-24-16-28-20/h1,4-5,10,13-16H,2-3,6-9,11-12H2,(H,23,27)(H,24,28)(H,25,29)(H,26,30)
Affinity DataKi: >1.00E+5nMAssay Description:Binding affinity against H2 receptor of Guinea pig atriumMore data for this Ligand-Target Pair
TargetHistamine H1 receptor(Cavia porcellus (domestic guinea pig))
Freie Universität Berlin

Curated by ChEMBL
LigandPNGBDBM50051194((3-{[3-(1H-Imidazol-4-yl)-propoxycarbonylamino]-me...)
Show SMILES O=C(NCc1cccc(CNC(=O)OCCCc2cnc[nH]2)c1)OCCCc1cnc[nH]1
Show InChI InChI=1S/C22H28N6O4/c29-21(31-8-2-6-19-13-23-15-27-19)25-11-17-4-1-5-18(10-17)12-26-22(30)32-9-3-7-20-14-24-16-28-20/h1,4-5,10,13-16H,2-3,6-9,11-12H2,(H,23,27)(H,24,28)(H,25,29)(H,26,30)
Affinity DataKi: >1.00E+5nMAssay Description:Binding affinity against H1 receptor of Guinea pig ileumMore data for this Ligand-Target Pair