Compile Data Set for Download or QSAR

Found 16 hits with Last Name = 'cardellini' and Initial = 'm'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50001955 ((-)6-Methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]qu...) Show SMILES CN1CCc2cccc-3c2[C@H]1Cc1ccc(O)c(O)c-31 |r| Show InChI InChI=1S/C17H17NO2/c1-18-8-7-10-3-2-4-12-15(10)13(18)9-11-5-6-14(19)17(20)16(11)12/h2-6,13,19-20H,7-9H2,1H3/t13-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]spiperone binding to Dopamine receptor D2 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50010733 (5-[2-(Ethyl-phenethyl-amino)-ethyl]-2-fluoro-pheno...) Show SMILES CCN(CCc1ccccc1)CCc1ccc(F)c(O)c1 Show InChI InChI=1S/C18H22FNO/c1-2-20(12-10-15-6-4-3-5-7-15)13-11-16-8-9-17(19)18(21)14-16/h3-9,14,21H,2,10-13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]spiperone binding to dopamine receptor D2 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50010731 (2-Fluoro-5-[2-(phenethyl-propyl-amino)-ethyl]-phen...) Show SMILES CCCN(CCc1ccccc1)CCc1ccc(F)c(O)c1 Show InChI InChI=1S/C19H24FNO/c1-2-12-21(13-10-16-6-4-3-5-7-16)14-11-17-8-9-18(20)19(22)15-17/h3-9,15,22H,2,10-14H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]spiperone binding to dopamine receptor D2 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50010729 (2-Fluoro-4-[2-(phenethyl-propyl-amino)-ethyl]-phen...) Show SMILES CCCN(CCc1ccccc1)CCc1ccc(O)c(F)c1 Show InChI InChI=1S/C19H24FNO/c1-2-12-21(13-10-16-6-4-3-5-7-16)14-11-17-8-9-19(22)18(20)15-17/h3-9,15,22H,2,10-14H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]spiperone binding to dopamine receptor D2 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50010732 (5-(2-Dipropylamino-ethyl)-2-fluoro-phenol; hydrobr...) Show SMILES CCCN(CCC)CCc1ccc(F)c(O)c1 Show InChI InChI=1S/C14H22FNO/c1-3-8-16(9-4-2)10-7-12-5-6-13(15)14(17)11-12/h5-6,11,17H,3-4,7-10H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	950	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]spiperone binding to dopamine receptor D2 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50010734 (5-[2-(Ethyl-propyl-amino)-ethyl]-2-fluoro-phenol; ...) Show SMILES CCCN(CC)CCc1ccc(F)c(O)c1 Show InChI InChI=1S/C13H20FNO/c1-3-8-15(4-2)9-7-11-5-6-12(14)13(16)10-11/h5-6,10,16H,3-4,7-9H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.97E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]spiperone binding to dopamine receptor D2 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM55121 (3-HYDROXYTYRAMINE HYDROCHLORIDE | 4-(2-aminoethyl)...) Show SMILES NCCc1ccc(O)c(O)c1 Show InChI InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase DrugBank KEGG PC cid PC sid PDB UniChem Similars	PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]spiperone binding to Dopamine receptor D2 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM50001955 ((-)6-Methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]qu...) Show SMILES CN1CCc2cccc-3c2[C@H]1Cc1ccc(O)c(O)c-31 |r| Show InChI InChI=1S/C17H17NO2/c1-18-8-7-10-3-2-4-12-15(10)13(18)9-11-5-6-14(19)17(20)16(11)12/h2-6,13,19-20H,7-9H2,1H3/t13-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]-SCH- 23390 binding to Dopamine receptor D1 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair				3D Structure (crystal)
D(1A) dopamine receptor (RAT)	BDBM55121 (3-HYDROXYTYRAMINE HYDROCHLORIDE | 4-(2-aminoethyl)...) Show SMILES NCCc1ccc(O)c(O)c1 Show InChI InChI=1S/C8H11NO2/c9-4-3-6-1-2-7(10)8(11)5-6/h1-2,5,10-11H,3-4,9H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase DrugBank KEGG PC cid PC sid PDB UniChem Similars	PDB PubMed	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]-SCH- 23390 binding to Dopamine receptor D1 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair				3D Structure (crystal)
D(2) dopamine receptor (Rattus norvegicus (rat))	BDBM50010730 (5-(2-Amino-ethyl)-2-fluoro-phenol; hydrobromide | ...) Show SMILES NCCc1ccc(F)c(O)c1 Show InChI InChI=1S/C8H10FNO/c9-7-2-1-6(3-4-10)5-8(7)11/h1-2,5,11H,3-4,10H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	4.64E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]spiperone binding to Dopamine receptor D2 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM50010730 (5-(2-Amino-ethyl)-2-fluoro-phenol; hydrobromide | ...) Show SMILES NCCc1ccc(F)c(O)c1 Show InChI InChI=1S/C8H10FNO/c9-7-2-1-6(3-4-10)5-8(7)11/h1-2,5,11H,3-4,10H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	6.15E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]-SCH- 23390 binding to Dopamine receptor D1 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM50010733 (5-[2-(Ethyl-phenethyl-amino)-ethyl]-2-fluoro-pheno...) Show SMILES CCN(CCc1ccccc1)CCc1ccc(F)c(O)c1 Show InChI InChI=1S/C18H22FNO/c1-2-20(12-10-15-6-4-3-5-7-15)13-11-16-8-9-17(19)18(21)14-16/h3-9,14,21H,2,10-13H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]-SCH- 23390 binding to Dopamine receptor D1 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM50010731 (2-Fluoro-5-[2-(phenethyl-propyl-amino)-ethyl]-phen...) Show SMILES CCCN(CCc1ccccc1)CCc1ccc(F)c(O)c1 Show InChI InChI=1S/C19H24FNO/c1-2-12-21(13-10-16-6-4-3-5-7-16)14-11-17-8-9-18(20)19(22)15-17/h3-9,15,22H,2,10-14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]-SCH- 23390 binding to Dopamine receptor D1 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM50010734 (5-[2-(Ethyl-propyl-amino)-ethyl]-2-fluoro-phenol; ...) Show SMILES CCCN(CC)CCc1ccc(F)c(O)c1 Show InChI InChI=1S/C13H20FNO/c1-3-8-15(4-2)9-7-11-5-6-12(14)13(16)10-11/h5-6,10,16H,3-4,7-9H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]-SCH- 23390 binding to Dopamine receptor D1 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM50010732 (5-(2-Dipropylamino-ethyl)-2-fluoro-phenol; hydrobr...) Show SMILES CCCN(CCC)CCc1ccc(F)c(O)c1 Show InChI InChI=1S/C14H22FNO/c1-3-8-16(9-4-2)10-7-12-5-6-13(15)14(17)11-12/h5-6,11,17H,3-4,7-10H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]-SCH- 23390 binding to Dopamine receptor D1 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair
D(1A) dopamine receptor (RAT)	BDBM50010729 (2-Fluoro-4-[2-(phenethyl-propyl-amino)-ethyl]-phen...) Show SMILES CCCN(CCc1ccccc1)CCc1ccc(O)c(F)c1 Show InChI InChI=1S/C19H24FNO/c1-2-12-21(13-10-16-6-4-3-5-7-16)14-11-17-8-9-19(22)18(20)15-17/h3-9,15,22H,2,10-14H2,1H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	3.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Camerino Curated by ChEMBL					Assay Description Compound was evaluated for the inhibition of [3H]-SCH- 23390 binding to Dopamine receptor D1 of rat striatal membranes				J Med Chem 33: 2408-12 (1990) BindingDB Entry DOI: 10.7270/Q29G5NFT
					More data for this Ligand-Target Pair