BDBM50168286 1H-Benzoimidazole-2-carboxylic acid [(R)-1-((1S,2R,3S)-1-cyclohexylmethyl-3-cyclopropyl-2,3-dihydroxy-propylcarbamoyl)-2-thiazol-4-yl-ethyl]-amide::CHEMBL190141
SMILES: O[C@H]([C@H](CC1CCCCC1)NC(=O)[C@@H](Cc1cscn1)NC(=O)c1nc2ccccc2[nH]1)[C@@H](O)C1CC1
InChI Key: InChIKey=JHRSGCIIDRWHCD-UARRHKHWSA-N
Data: 5 IC50
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
P2X purinoceptor 3 (Homo sapiens (Human)) | BDBM50168286 (1H-Benzoimidazole-2-carboxylic acid [(R)-1-((1S,2R...) | PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Palo Alto Curated by ChEMBL | Assay Description Inhibitory concentration against human P2X purinoceptor 3 (hP2X3) expressed in CHO-K1 cells | Bioorg Med Chem Lett 15: 3292-5 (2005) Article DOI: 10.1016/j.bmcl.2005.04.049 BindingDB Entry DOI: 10.7270/Q2GX4B38 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
P2X purinoceptor 1 (Homo sapiens (Human)) | BDBM50168286 (1H-Benzoimidazole-2-carboxylic acid [(R)-1-((1S,2R...) | Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Palo Alto Curated by ChEMBL | Assay Description Inhibitory concentration against human P2X purinoreceptor 1 (hP2X1) expressed in CHO-K1 cells | Bioorg Med Chem Lett 15: 3292-5 (2005) Article DOI: 10.1016/j.bmcl.2005.04.049 BindingDB Entry DOI: 10.7270/Q2GX4B38 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
P2X purinoceptor 1 (Homo sapiens (Human)) | BDBM50168286 (1H-Benzoimidazole-2-carboxylic acid [(R)-1-((1S,2R...) | Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem | PubMed | n/a | n/a | 496 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn Curated by ChEMBL | Assay Description Antagonist activity at non-desensitizing human P2X1 receptor ( P2X2/P2X1 chimera) expressed in human 1321N1 cells assessed as inhibition of ATP-induc... | J Med Chem 63: 6164-6178 (2020) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
P2X purinoceptor 1 (RAT) | BDBM50168286 (1H-Benzoimidazole-2-carboxylic acid [(R)-1-((1S,2R...) | Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem | PubMed | n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Bonn Curated by ChEMBL | Assay Description Antagonist activity at rat P2X1 receptor | J Med Chem 63: 6164-6178 (2020) | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
P2X purinoceptor 2 (Homo sapiens (Human)) | BDBM50168286 (1H-Benzoimidazole-2-carboxylic acid [(R)-1-((1S,2R...) | UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Roche Palo Alto Curated by ChEMBL | Assay Description Inhibitory concentration against human P2X purinoceptor 2 (hP2X2) expressed in 1321N1 astrocytoma cells | Bioorg Med Chem Lett 15: 3292-5 (2005) Article DOI: 10.1016/j.bmcl.2005.04.049 BindingDB Entry DOI: 10.7270/Q2GX4B38 | |||||||||||
More data for this Ligand-Target Pair |