Compounds in cluster

10 molecules are shown

Wt: 285.1 BDBM50225216	Wt: 248.7 BDBM50225218	Wt: 228.2 BDBM50225219 Purchase	Wt: 320.2 BDBM50225222	Wt: 283.1 BDBM50225224
Wt: 216.2 BDBM50225225	Wt: 313.1 BDBM50225226	Wt: 230.2 BDBM50225228	Wt: 334.2 BDBM50225230 Purchase	Wt: 244.2 BDBM50225231

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 50225216,50225218,50225219,50225222,50225224,50225225,50225226,50225228,50225230,50225231
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Transthyretin (Homo sapiens (Human))	BDBM50225216 (2-(2,4-dichlorophenoxy)-5-(hydroxymethyl)phenol \| ...) Show SMILES OCc1ccc(Oc2ccc(Cl)cc2Cl)c(O)c1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	0.300	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Binding affinity to transthyretin at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Transthyretin (Homo sapiens (Human))	BDBM50225231 (3-methoxy-4-phenoxybenzoic acid \| CHEMBL392872) Show SMILES COc1cc(ccc1Oc1ccccc1)C(O)=O Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	4.10E+4	n/a	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Inhibition of transthyretin fibril formation at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Transthyretin (Homo sapiens (Human))	BDBM50225216 (2-(2,4-dichlorophenoxy)-5-(hydroxymethyl)phenol \| ...) Show SMILES OCc1ccc(Oc2ccc(Cl)cc2Cl)c(O)c1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.36E+3	n/a	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Inhibition of transthyretin fibril formation at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Transthyretin (Homo sapiens (Human))	BDBM50225219 (3-methoxy-4-phenoxybenzaldehyde \| CHEMBL241453) Show SMILES COc1cc(C=O)ccc1Oc1ccccc1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	88	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Binding affinity to transthyretin at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Transthyretin (Homo sapiens (Human))	BDBM50225224 (4-(2,4-dichlorophenoxy)-3-hydroxybenzaldehyde \| CH...) Show SMILES Oc1cc(C=O)ccc1Oc1ccc(Cl)cc1Cl Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	13.9	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Binding affinity to transthyretin at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Transthyretin (Homo sapiens (Human))	BDBM50225222 ((4-(2,4-dinitrophenoxy)-3-methoxyphenyl)methanol \|...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Inhibition of transthyretin fibril formation at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Transthyretin (Homo sapiens (Human))	BDBM50225225 (5-(hydroxymethyl)-2-phenoxyphenol \| CHEMBL238590) Show SMILES OCc1ccc(Oc2ccccc2)c(O)c1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.50E+4	n/a	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Inhibition of transthyretin fibril formation at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Transthyretin (Homo sapiens (Human))	BDBM50225226 (4-(2,4-dichlorophenoxy)-3-methoxybenzoic acid \| CH...) Show SMILES COc1cc(ccc1Oc1ccc(Cl)cc1Cl)C(O)=O Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	475	n/a	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Inhibition of transthyretin fibril formation at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Transthyretin (Homo sapiens (Human))	BDBM50225226 (4-(2,4-dichlorophenoxy)-3-methoxybenzoic acid \| CH...) Show SMILES COc1cc(ccc1Oc1ccc(Cl)cc1Cl)C(O)=O Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	0.200	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Binding affinity to transthyretin at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Transthyretin (Homo sapiens (Human))	BDBM50225230 (4-(2,4-dinitrophenoxy)-3-methoxybenzoic acid \| CHE...) Show SMILES Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Inhibition of transthyretin fibril formation at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Transthyretin (Homo sapiens (Human))	BDBM50225228 (3-hydroxy-4-phenoxybenzoic acid \| CHEMBL241454) Show SMILES OC(=O)c1ccc(Oc2ccccc2)c(O)c1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.18E+3	n/a	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Inhibition of transthyretin fibril formation at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Transthyretin (Homo sapiens (Human))	BDBM50225219 (3-methoxy-4-phenoxybenzaldehyde \| CHEMBL241453) Show SMILES COc1cc(C=O)ccc1Oc1ccccc1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.31E+3	n/a	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Inhibition of transthyretin fibril formation at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Transthyretin (Homo sapiens (Human))	BDBM50225224 (4-(2,4-dichlorophenoxy)-3-hydroxybenzaldehyde \| CH...) Show SMILES Oc1cc(C=O)ccc1Oc1ccc(Cl)cc1Cl Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	520	n/a	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Inhibition of transthyretin fibril formation at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair				3D Structure (crystal)
Transthyretin (Homo sapiens (Human))	BDBM50225228 (3-hydroxy-4-phenoxybenzoic acid \| CHEMBL241454) Show SMILES OC(=O)c1ccc(Oc2ccccc2)c(O)c1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	27	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Binding affinity to transthyretin at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair
Transthyretin (Homo sapiens (Human))	BDBM50225218 (4-(chloromethyl)-2-methoxy-1-phenoxybenzene \| CHEM...) Show SMILES COc1cc(CCl)ccc1Oc1ccccc1 Show InChI	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.94E+3	n/a	n/a	n/a	n/a	4.4	n/a
Institute of Sciences Curated by ChEMBL					Assay Description Inhibition of transthyretin fibril formation at pH 4.4				J Med Chem 50: 5589-99 (2007) Article DOI: 10.1021/jm0700159 BindingDB Entry DOI: 10.7270/Q2PG1RGD
Institute of Sciences Curated by ChEMBL					More data for this Ligand-Target Pair