Compile Data Set for Download or QSAR

Found 694 hits with Last Name = 'lee' and Initial = 'jk'   

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
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486975 (CHEMBL2251221) Show SMILES C[C@@H](NC(=O)[C@@]1(C[C@@](C)(Cl)C1)C(F)(F)F)c1ccc(Cl)cc1Cl |r,wU:7.8,wD:5.4,1.0,(9.6,-20.54,;9.61,-22.08,;8.29,-22.87,;6.95,-22.11,;6.93,-20.57,;5.62,-22.9,;4.51,-23.96,;3.44,-22.85,;2.34,-23.93,;2.1,-22.07,;4.55,-21.79,;6.7,-23.98,;6.31,-25.47,;8.19,-23.58,;7.79,-25.07,;10.95,-22.84,;10.96,-24.38,;12.3,-25.13,;13.63,-24.35,;14.97,-25.1,;13.61,-22.8,;12.27,-22.05,;12.24,-20.51,)| Show InChI InChI=1S/C15H15Cl3F3NO/c1-8(10-4-3-9(16)5-11(10)17)22-12(23)14(15(19,20)21)6-13(2,18)7-14/h3-5,8H,6-7H2,1-2H3,(H,22,23)/t8-,13-,14+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.0110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486958 (CHEMBL2251869) Show SMILES C[C@@H](NC(=O)[C@@]1(C)C[C@@](C)(Cl)C1)c1ccc(Cl)cc1Cl |r,wU:5.4,8.9,wD:1.0,(10.61,-1.98,;10.62,-3.52,;9.3,-4.3,;7.96,-3.55,;7.94,-2.01,;6.63,-4.33,;6.62,-5.86,;5.55,-5.43,;4.45,-4.34,;3.11,-5.1,;3.35,-3.24,;5.54,-3.25,;11.97,-4.27,;11.97,-5.81,;13.31,-6.57,;14.64,-5.78,;15.98,-6.54,;14.62,-4.24,;13.28,-3.49,;13.25,-1.95,)| Show InChI InChI=1S/C15H18Cl3NO/c1-9(11-5-4-10(16)6-12(11)17)19-13(20)14(2)7-15(3,18)8-14/h4-6,9H,7-8H2,1-3H3,(H,19,20)/t9-,14-,15+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.0120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486961 (CHEMBL2251863) Show SMILES C[C@@H](NC(=O)[C@]1(C)C[C@@](Cl)(CCl)C1)c1ccc(Br)cc1 |r,wU:8.9,wD:5.4,1.0,(9.94,-41.23,;9.96,-42.77,;8.63,-43.55,;7.29,-42.8,;7.27,-41.26,;5.97,-43.58,;5.95,-45.11,;4.88,-44.67,;3.78,-43.59,;2.68,-42.49,;2.44,-44.35,;1.11,-43.57,;4.87,-42.5,;11.3,-43.52,;11.31,-45.06,;12.65,-45.82,;13.97,-45.03,;15.32,-45.79,;13.95,-43.48,;12.61,-42.74,)| Show InChI InChI=1S/C15H18BrCl2NO/c1-10(11-3-5-12(16)6-4-11)19-13(20)14(2)7-15(18,8-14)9-17/h3-6,10H,7-9H2,1-2H3,(H,19,20)/t10-,14-,15+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.0160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486969 (CHEMBL2251871) Show SMILES C[C@@H](NC(=O)[C@@]1(C)C[C@@](C)(Cl)C1)c1ccc2ccccc2c1 |r,wU:5.4,8.9,wD:1.0,(40.37,-2.17,;40.39,-3.71,;39.06,-4.5,;37.72,-3.74,;37.71,-2.2,;36.4,-4.52,;36.39,-6.06,;35.31,-5.62,;34.22,-4.54,;32.88,-5.3,;33.12,-3.44,;35.3,-3.44,;41.73,-4.47,;41.74,-6.01,;43.08,-6.76,;44.41,-5.98,;45.75,-6.73,;47.08,-5.93,;47.05,-4.38,;45.7,-3.64,;44.38,-4.43,;43.04,-3.68,)| Show InChI InChI=1S/C19H22ClNO/c1-13(21-17(22)18(2)11-19(3,20)12-18)15-9-8-14-6-4-5-7-16(14)10-15/h4-10,13H,11-12H2,1-3H3,(H,21,22)/t13-,18-,19+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.0160	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486960 (CHEMBL2251864) Show SMILES CC[C@@]1(C[C@@](C)(Cl)C1)C(=O)N[C@H](C)c1ccc(Br)cc1 |r,wU:2.8,4.5,wD:11.12,(22.61,-45.48,;21.28,-44.7,;21.3,-43.16,;20.21,-44.26,;19.11,-43.18,;17.77,-43.94,;18.01,-42.08,;20.2,-42.08,;22.62,-42.38,;22.6,-40.84,;23.96,-43.14,;25.29,-42.36,;25.27,-40.82,;26.63,-43.11,;26.64,-44.65,;27.98,-45.4,;29.3,-44.62,;30.65,-45.37,;29.28,-43.07,;27.94,-42.32,)| Show InChI InChI=1S/C16H21BrClNO/c1-4-16(9-15(3,18)10-16)14(20)19-11(2)12-5-7-13(17)8-6-12/h5-8,11H,4,9-10H2,1-3H3,(H,19,20)/t11-,15-,16+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.0210	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486966 (CHEMBL2114191) Show SMILES C[C@@H](NC(=O)[C@]1(C[C@@](C)(Cl)C1)C(F)(F)F)c1ccc(Br)cc1 |wU:5.4,wD:7.7,1.0,(6.11,-1.45,;6.11,-2.99,;4.79,-3.76,;3.47,-2.99,;3.47,-1.45,;1.92,-2.99,;.83,-4.07,;-.25,-2.98,;-1.03,-1.65,;-1.34,-4.05,;.84,-1.9,;2.32,-4.47,;2.71,-5.97,;1.28,-5.9,;3.92,-5.2,;7.45,-3.76,;7.45,-5.3,;8.79,-6.07,;10.12,-5.3,;11.45,-6.07,;10.12,-3.76,;8.79,-2.99,)| Show InChI InChI=1S/C15H16BrClF3NO/c1-9(10-3-5-11(16)6-4-10)21-12(22)14(15(18,19)20)7-13(2,17)8-14/h3-6,9H,7-8H2,1-2H3,(H,21,22)/t9-,13-,14-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.0260	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486974 (CHEMBL2251862) Show SMILES C[C@@H](NC(=O)[C@@]1(C)C[C@@](Cl)(CCl)C1)c1ccc(Br)cc1 |r,wU:5.4,8.9,wD:1.0,(40.03,-33.88,;40.05,-35.42,;38.72,-36.2,;37.38,-35.45,;37.37,-33.91,;36.06,-36.23,;36.04,-37.76,;34.97,-37.32,;33.88,-36.24,;32.54,-37,;32.78,-35.14,;33.17,-33.65,;34.96,-35.15,;41.39,-36.17,;41.4,-37.71,;42.74,-38.47,;44.07,-37.68,;45.41,-38.44,;44.05,-36.13,;42.7,-35.39,)| Show InChI InChI=1S/C15H18BrCl2NO/c1-10(11-3-5-12(16)6-4-11)19-13(20)14(2)7-15(18,8-14)9-17/h3-6,10H,7-9H2,1-2H3,(H,19,20)/t10-,14-,15-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.0270	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486972 (CHEMBL2251872) Show SMILES COc1cc(Br)ccc1C(C)NC(=O)[C@@]1(C)C[C@@](C)(Cl)C1 |r,wU:14.14,17.19,(13.59,-9.79,;12.27,-10.58,;12.29,-12.12,;13.63,-12.87,;13.65,-14.42,;15,-15.17,;12.33,-15.2,;10.99,-14.45,;10.98,-12.91,;9.64,-12.15,;9.62,-10.61,;8.31,-12.94,;6.97,-12.18,;6.95,-10.64,;5.65,-12.96,;5.63,-14.5,;4.56,-14.06,;3.46,-12.97,;2.12,-13.74,;2.36,-11.88,;4.55,-11.88,)| Show InChI InChI=1S/C16H21BrClNO2/c1-10(12-6-5-11(17)7-13(12)21-4)19-14(20)15(2)8-16(3,18)9-15/h5-7,10H,8-9H2,1-4H3,(H,19,20)/t10?,15-,16+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.0300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486967 (CHEBI:81799 | DICLOCYMET) Show SMILES C[C@@H](NC(=O)C(C#N)C(C)(C)C)c1ccc(Cl)cc1Cl |r| Show InChI InChI=1S/C15H18Cl2N2O/c1-9(11-6-5-10(16)7-13(11)17)19-14(20)12(8-18)15(2,3)4/h5-7,9,12H,1-4H3,(H,19,20)/t9-,12?/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem	Article PubMed	0.0360	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50078312 (2,2-Dichloro-1-ethyl-3-methyl-cyclopropanecarboxyl...) Show SMILES CCC1(C(C)C1(Cl)Cl)C(=O)N[C@H](C)c1ccc(Cl)cc1 Show InChI InChI=1S/C15H18Cl3NO/c1-4-14(10(3)15(14,17)18)13(20)19-9(2)11-5-7-12(16)8-6-11/h5-10H,4H2,1-3H3,(H,19,20)/t9-,10?,14?/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	0.0410	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486952 (CHEMBL2251854) Show SMILES C[C@H](COc1cc(F)ccc1Cl)NC(=O)[C@@]1(C)C[C@@](C)(Cl)C1 |r,wU:15.15,18.20,wD:1.0,(41.6,-11.34,;41.61,-12.88,;42.95,-13.63,;44.28,-12.85,;45.62,-13.6,;45.63,-15.14,;46.97,-15.89,;46.99,-17.43,;48.3,-15.11,;48.28,-13.56,;46.94,-12.81,;46.91,-11.27,;40.29,-13.66,;38.95,-12.9,;38.93,-11.36,;37.62,-13.68,;37.61,-15.22,;36.53,-14.78,;35.44,-13.7,;34.1,-14.46,;34.34,-12.6,;36.53,-12.6,)| Show InChI InChI=1S/C16H20Cl2FNO2/c1-10(7-22-13-6-11(19)4-5-12(13)17)20-14(21)15(2)8-16(3,18)9-15/h4-6,10H,7-9H2,1-3H3,(H,20,21)/t10-,15-,16+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.0570	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486954 (CHEMBL2251875) Show SMILES C[C@@H](NC(=O)[C@@]1(C[C@@](C)(Cl)C1)C(F)(F)F)c1ccc(Cl)cc1 |r,wU:7.8,wD:1.0,5.4,(29.18,-22.69,;29.2,-24.23,;27.87,-25.01,;26.53,-24.26,;26.51,-22.72,;25.2,-25.04,;24.09,-26.11,;23.02,-25,;21.92,-26.08,;21.68,-24.22,;24.14,-23.93,;25.97,-26.37,;25.21,-27.71,;26.74,-27.7,;27.44,-26.76,;30.54,-24.99,;31.85,-24.2,;33.19,-24.95,;33.21,-26.5,;34.56,-27.25,;31.89,-27.28,;30.55,-26.52,)| Show InChI InChI=1S/C15H16Cl2F3NO/c1-9(10-3-5-11(16)6-4-10)21-12(22)14(15(18,19)20)7-13(2,17)8-14/h3-6,9H,7-8H2,1-2H3,(H,21,22)/t9-,13-,14+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.0670	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486953 (CHEMBL2251861) Show SMILES C[C@@H](NC(=O)[C@@]1(C)C[C@@](C)(Cl)C1)c1ccc(Br)cc1 |r,wU:5.4,8.9,wD:1.0,(24.86,-34.05,;24.87,-35.59,;23.55,-36.37,;22.21,-35.62,;22.19,-34.08,;20.88,-36.4,;20.87,-37.93,;19.8,-37.5,;18.7,-36.41,;17.36,-37.17,;17.6,-35.31,;19.79,-35.32,;26.22,-36.34,;26.22,-37.88,;27.56,-38.64,;28.89,-37.85,;30.23,-38.61,;28.87,-36.31,;27.53,-35.56,)| Show InChI InChI=1S/C15H19BrClNO/c1-10(11-4-6-12(16)7-5-11)18-13(19)14(2)8-15(3,17)9-14/h4-7,10H,8-9H2,1-3H3,(H,18,19)/t10-,14-,15+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486956 (CHEMBL2251991) Show SMILES CC(C)C(C)(NC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl)C#N |r| Show InChI InChI=1S/C15H18Cl2N2O2/c1-9(2)15(4,8-18)19-14(20)10(3)21-13-6-5-11(16)7-12(13)17/h5-7,9-10H,1-4H3,(H,19,20)/t10-,15?/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase KEGG PC cid PC sid UniChem	Article PubMed	0.130	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486962 (CHEMBL2251860) Show SMILES C[C@@H](NC(=O)C1(Cl)CC(C)(Cl)C1)c1ccc(Br)cc1 |r,wD:1.0,(8.76,-34.34,;8.77,-35.88,;7.45,-36.66,;6.11,-35.9,;6.09,-34.36,;4.78,-36.68,;4.77,-38.22,;3.69,-37.78,;2.6,-36.7,;1.26,-37.46,;1.5,-35.6,;3.69,-35.6,;10.12,-36.63,;10.12,-38.17,;11.46,-38.93,;12.79,-38.14,;14.13,-38.9,;12.77,-36.59,;11.43,-35.84,)| Show InChI InChI=1S/C14H16BrCl2NO/c1-9(10-3-5-11(15)6-4-10)18-12(19)14(17)7-13(2,16)8-14/h3-6,9H,7-8H2,1-2H3,(H,18,19)/t9-,13?,14?/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.310	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50098551 ((R)-3-(2-(2-(4-methylpiperidin-1-yl)ethyl)pyrrolid...) Show SMILES CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(O)c2)CC1 |r| Show InChI InChI=1S/C18H28N2O3S/c1-15-7-11-19(12-8-15)13-9-16-4-3-10-20(16)24(22,23)18-6-2-5-17(21)14-18/h2,5-6,14-16,21H,3-4,7-13H2,1H3/t16-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	0.339	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50098551 ((R)-3-(2-(2-(4-methylpiperidin-1-yl)ethyl)pyrrolid...) Show SMILES CC1CCN(CC[C@H]2CCCN2S(=O)(=O)c2cccc(O)c2)CC1 |r| Show InChI InChI=1S/C18H28N2O3S/c1-15-7-11-19(12-8-15)13-9-16-4-3-10-20(16)24(22,23)18-6-2-5-17(21)14-18/h2,5-6,14-16,21H,3-4,7-13H2,1H3/t16-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	0.340	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486964 (CHEMBL2251855) Show SMILES C[C@H](COc1ccccc1F)NC(=O)[C@@]1(C[C@@](C)(Cl)C1)C(F)(F)F |r,wU:16.18,wD:14.14,1.0,(25.38,-23.54,;25.39,-25.08,;26.73,-25.83,;28.05,-25.06,;29.39,-25.81,;29.4,-27.35,;30.74,-28.11,;32.07,-27.32,;32.05,-25.77,;30.7,-25.03,;30.68,-23.48,;24.06,-25.86,;22.71,-25.11,;22.7,-23.56,;21.38,-25.89,;20.27,-26.95,;19.21,-25.84,;18.1,-26.92,;17.87,-25.07,;20.32,-24.78,;22.17,-27.21,;22.95,-28.54,;23.71,-27.19,;21.41,-28.55,)| Show InChI InChI=1S/C16H18ClF4NO2/c1-10(7-24-12-6-4-3-5-11(12)18)22-13(23)15(16(19,20)21)8-14(2,17)9-15/h3-6,10H,7-9H2,1-2H3,(H,22,23)/t10-,14-,15+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.350	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486968 (CHEMBL2251873) Show SMILES C[C@H](COc1cc(F)ccc1F)NC(=O)[C@@]1(C)C[C@@](C)(Cl)C1 |r,wU:15.15,18.20,wD:1.0,(25.12,-11.31,;25.14,-12.85,;26.48,-13.61,;27.81,-12.82,;29.15,-13.58,;29.16,-15.12,;30.5,-15.87,;30.51,-17.41,;31.82,-15.09,;31.8,-13.54,;30.46,-12.79,;30.44,-11.25,;23.81,-13.64,;22.47,-12.88,;22.45,-11.34,;21.15,-13.66,;21.13,-15.2,;20.06,-14.76,;18.97,-13.68,;17.63,-14.44,;17.87,-12.58,;20.05,-12.58,)| Show InChI InChI=1S/C16H20ClF2NO2/c1-10(7-22-13-6-11(18)4-5-12(13)19)20-14(21)15(2)8-16(3,17)9-15/h4-6,10H,7-9H2,1-3H3,(H,20,21)/t10-,15-,16+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.420	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486965 (CHEMBL2251874) Show SMILES C[C@@H](NC(=O)[C@@]1(C[C@@](C)(Cl)C1)C(F)(F)F)c1ccc(Br)cc1 |r,wU:7.8,wD:5.4,1.0,(24.57,-11.74,;24.59,-13.28,;23.26,-14.06,;21.92,-13.31,;21.9,-11.77,;20.59,-14.09,;19.48,-15.16,;18.41,-14.05,;17.31,-15.13,;17.07,-13.27,;19.53,-12.98,;21.68,-15.17,;21.28,-16.66,;23.16,-14.77,;22.77,-16.26,;25.93,-14.04,;25.93,-15.57,;27.28,-16.33,;28.6,-15.54,;29.95,-16.3,;28.58,-14,;27.24,-13.25,)| Show InChI InChI=1S/C15H16BrClF3NO/c1-9(10-3-5-11(16)6-4-10)21-12(22)14(15(18,19)20)7-13(2,17)8-14/h3-6,9H,7-8H2,1-2H3,(H,21,22)/t9-,13-,14+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.430	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486977 (CHEMBL2251858) Show SMILES C[C@@H](NC(=O)C1(Cl)CC(Cl)(Cl)C1)c1ccc(Br)cc1 |r| Show InChI InChI=1S/C13H13BrCl3NO/c1-8(9-2-4-10(14)5-3-9)18-11(19)12(15)6-13(16,17)7-12/h2-5,8H,6-7H2,1H3,(H,18,19)/t8-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.450	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486955 (CHEMBL2251868) Show SMILES CC[C@]1(O)C[C@](C)(C1)C(=O)N[C@H](C)c1ccc(Br)cc1 |r,wU:5.8,2.2,wD:11.12,(36.99,-50.83,;38.3,-51.64,;39.65,-50.87,;38.55,-49.78,;40.73,-49.78,;41.83,-50.86,;41.81,-52.4,;40.74,-51.96,;43.15,-50.08,;43.13,-48.54,;44.49,-50.84,;45.82,-50.05,;45.8,-48.51,;47.16,-50.81,;47.17,-52.35,;48.51,-53.1,;49.83,-52.32,;51.18,-53.07,;49.81,-50.77,;48.47,-50.02,)| Show InChI InChI=1S/C16H22BrNO2/c1-4-16(20)9-15(3,10-16)14(19)18-11(2)12-5-7-13(17)8-6-12/h5-8,11,20H,4,9-10H2,1-3H3,(H,18,19)/t11-,15-,16+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486957 (CHEMBL2251870) Show SMILES C[C@@H](NC(=O)[C@@]1(C)C[C@@](C)(Cl)C1)c1cccc2ccccc12 |r,wU:5.4,8.9,wD:1.0,(25.24,-2.35,;25.25,-3.89,;23.93,-4.68,;22.59,-3.92,;22.57,-2.38,;21.26,-4.7,;21.25,-6.24,;20.18,-5.8,;19.08,-4.71,;17.74,-5.48,;17.98,-3.62,;20.17,-3.62,;26.6,-4.65,;26.6,-6.19,;27.94,-6.94,;29.27,-6.16,;29.25,-4.61,;30.57,-3.83,;30.54,-2.29,;29.19,-1.54,;27.88,-2.33,;27.91,-3.86,)| Show InChI InChI=1S/C19H22ClNO/c1-13(21-17(22)18(2)11-19(3,20)12-18)15-10-6-8-14-7-4-5-9-16(14)15/h4-10,13H,11-12H2,1-3H3,(H,21,22)/t13-,18-,19+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486963 (CHEMBL2251859) Show SMILES C[C@@H](NC(=O)C1(C)CC(F)(F)C1)c1ccc(Br)cc1 |r| Show InChI InChI=1S/C14H16BrF2NO/c1-9(10-3-5-11(15)6-4-10)18-12(19)13(2)7-14(16,17)8-13/h3-6,9H,7-8H2,1-2H3,(H,18,19)/t9-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50458557 (CHEMBL4215875) Show SMILES Cc1ccc(cc1)-c1noc2CCNCCc12 Show InChI InChI=1S/C14H16N2O/c1-10-2-4-11(5-3-10)14-12-6-8-15-9-7-13(12)17-16-14/h2-5,15H,6-9H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486973 (CHEMBL2251866) Show SMILES C[C@@H](NC(=O)[C@]1(C)C[C@@](C)(O)C1)c1ccc(Br)cc1 |r,wU:8.9,wD:5.4,1.0,(11.75,-47.57,;11.77,-49.11,;10.44,-49.9,;9.1,-49.14,;9.08,-47.6,;7.78,-49.92,;7.76,-51.46,;6.69,-51.02,;5.6,-49.94,;4.25,-50.7,;4.5,-48.84,;6.68,-48.84,;13.11,-49.87,;13.12,-51.41,;14.46,-52.16,;15.78,-51.38,;17.13,-52.13,;15.76,-49.83,;14.42,-49.08,)| Show InChI InChI=1S/C15H20BrNO2/c1-10(11-4-6-12(16)7-5-11)17-13(18)14(2)8-15(3,19)9-14/h4-7,10,19H,8-9H2,1-3H3,(H,17,18)/t10-,14-,15-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50458557 (CHEMBL4215875) Show SMILES Cc1ccc(cc1)-c1noc2CCNCCc12 Show InChI InChI=1S/C14H16N2O/c1-10-2-4-11(5-3-10)14-12-6-8-15-9-7-13(12)17-16-14/h2-5,15H,6-9H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2C (Homo sapiens (Human))	BDBM50458557 (CHEMBL4215875) Show SMILES Cc1ccc(cc1)-c1noc2CCNCCc12 Show InChI InChI=1S/C14H16N2O/c1-10-2-4-11(5-3-10)14-12-6-8-15-9-7-13(12)17-16-14/h2-5,15H,6-9H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT2C receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486970 (CHEMBL2251867) Show SMILES C[C@@H](NC(=O)[C@]1(C)C[C@](O)(C1)C#C)c1ccc(Br)cc1 |r,wU:5.4,8.8,wD:1.0,(29.6,-48.09,;29.62,-49.63,;28.29,-50.42,;26.95,-49.66,;26.93,-48.12,;25.63,-50.44,;25.61,-51.98,;24.53,-49.36,;23.44,-50.45,;22.34,-49.36,;24.54,-51.54,;22.1,-51.22,;20.78,-51.99,;30.96,-50.39,;30.97,-51.93,;32.31,-52.68,;33.63,-51.9,;34.98,-52.65,;33.61,-50.35,;32.27,-49.6,)| Show InChI InChI=1S/C16H18BrNO2/c1-4-16(20)9-15(3,10-16)14(19)18-11(2)12-5-7-13(17)8-6-12/h1,5-8,11,20H,9-10H2,2-3H3,(H,18,19)/t11-,15-,16+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50458555 (CHEMBL4207884) Show SMILES Clc1ccc(cc1)-c1n[nH]c2CCNCCc12 Show InChI InChI=1S/C13H14ClN3/c14-10-3-1-9(2-4-10)13-11-5-7-15-8-6-12(11)16-17-13/h1-4,15H,5-8H2,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50458555 (CHEMBL4207884) Show SMILES Clc1ccc(cc1)-c1n[nH]c2CCNCCc12 Show InChI InChI=1S/C13H14ClN3/c14-10-3-1-9(2-4-10)13-11-5-7-15-8-6-12(11)16-17-13/h1-4,15H,5-8H2,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
Scytalone dehydratase (Magnaporthe grisea)	BDBM50486976 (CHEMBL2251857) Show SMILES C[C@@H](NC(=O)[C@H]1C[C@@](C)(Cl)C1)c1ccc(Br)cc1 |r,wU:5.4,7.8,wD:1.0,(7.79,-27.66,;7.81,-29.2,;6.48,-29.98,;5.14,-29.23,;5.12,-27.69,;3.82,-30.01,;2.73,-31.11,;1.64,-30.02,;.3,-30.78,;.54,-28.92,;2.72,-28.93,;9.15,-29.96,;9.16,-31.49,;10.5,-32.25,;11.82,-31.46,;13.17,-32.22,;11.8,-29.92,;10.46,-29.17,)| Show InChI InChI=1S/C14H17BrClNO/c1-9(10-3-5-12(15)6-4-10)17-13(18)11-7-14(2,16)8-11/h3-6,9,11H,7-8H2,1-2H3,(H,17,18)/t9-,11-,14+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	44	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Stine Haskell Research Center Curated by ChEMBL					Assay Description Inhibition of Magnaporthe grisea scytalone dehydratase				Bioorg Med Chem 8: 897-907 (2000) Article DOI: 10.1016/s0968-0896(00)00034-1 BindingDB Entry DOI: 10.7270/Q2SX6H4B
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50458558 (CHEMBL4210782) Show SMILES Cc1ccc(cc1)-c1n[nH]c2CCNCCc12 Show InChI InChI=1S/C14H17N3/c1-10-2-4-11(5-3-10)14-12-6-8-15-9-7-13(12)16-17-14/h2-5,15H,6-9H2,1H3,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	47	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50458558 (CHEMBL4210782) Show SMILES Cc1ccc(cc1)-c1n[nH]c2CCNCCc12 Show InChI InChI=1S/C14H17N3/c1-10-2-4-11(5-3-10)14-12-6-8-15-9-7-13(12)16-17-14/h2-5,15H,6-9H2,1H3,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	47	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50458553 (CHEMBL4218672) Show SMILES Fc1ccc(cc1)-c1noc2CCNCCc12 Show InChI InChI=1S/C13H13FN2O/c14-10-3-1-9(2-4-10)13-11-5-7-15-8-6-12(11)17-16-13/h1-4,15H,5-8H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	52	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50458553 (CHEMBL4218672) Show SMILES Fc1ccc(cc1)-c1noc2CCNCCc12 Show InChI InChI=1S/C13H13FN2O/c14-10-3-1-9(2-4-10)13-11-5-7-15-8-6-12(11)17-16-13/h1-4,15H,5-8H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	53	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50458554 (CHEMBL4218801) Show SMILES Clc1ccc(cc1)-c1noc2CCNCCc12 Show InChI InChI=1S/C13H13ClN2O/c14-10-3-1-9(2-4-10)13-11-5-7-15-8-6-12(11)17-16-13/h1-4,15H,5-8H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50458554 (CHEMBL4218801) Show SMILES Clc1ccc(cc1)-c1noc2CCNCCc12 Show InChI InChI=1S/C13H13ClN2O/c14-10-3-1-9(2-4-10)13-11-5-7-15-8-6-12(11)17-16-13/h1-4,15H,5-8H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	71	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50458550 (CHEMBL4209274) Show SMILES Fc1ccc(cc1)-c1n[nH]c2CCNCCc12 Show InChI InChI=1S/C13H14FN3/c14-10-3-1-9(2-4-10)13-11-5-7-15-8-6-12(11)16-17-13/h1-4,15H,5-8H2,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	97	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT2B receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50458555 (CHEMBL4207884) Show SMILES Clc1ccc(cc1)-c1n[nH]c2CCNCCc12 Show InChI InChI=1S/C13H14ClN3/c14-10-3-1-9(2-4-10)13-11-5-7-15-8-6-12(11)16-17-13/h1-4,15H,5-8H2,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT2B receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50458550 (CHEMBL4209274) Show SMILES Fc1ccc(cc1)-c1n[nH]c2CCNCCc12 Show InChI InChI=1S/C13H14FN3/c14-10-3-1-9(2-4-10)13-11-5-7-15-8-6-12(11)16-17-13/h1-4,15H,5-8H2,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	104	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 7 (Homo sapiens (Human))	BDBM50458550 (CHEMBL4209274) Show SMILES Fc1ccc(cc1)-c1n[nH]c2CCNCCc12 Show InChI InChI=1S/C13H14FN3/c14-10-3-1-9(2-4-10)13-11-5-7-15-8-6-12(11)16-17-13/h1-4,15H,5-8H2,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	105	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT7 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50458558 (CHEMBL4210782) Show SMILES Cc1ccc(cc1)-c1n[nH]c2CCNCCc12 Show InChI InChI=1S/C14H17N3/c1-10-2-4-11(5-3-10)14-12-6-8-15-9-7-13(12)16-17-14/h2-5,15H,6-9H2,1H3,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	106	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT2B receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 6 (Homo sapiens (Human))	BDBM50458558 (CHEMBL4210782) Show SMILES Cc1ccc(cc1)-c1n[nH]c2CCNCCc12 Show InChI InChI=1S/C14H17N3/c1-10-2-4-11(5-3-10)14-12-6-8-15-9-7-13(12)16-17-14/h2-5,15H,6-9H2,1H3,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	109	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT6 receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50458557 (CHEMBL4215875) Show SMILES Cc1ccc(cc1)-c1noc2CCNCCc12 Show InChI InChI=1S/C14H16N2O/c1-10-2-4-11(5-3-10)14-12-6-8-15-9-7-13(12)17-16-14/h2-5,15H,6-9H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	138	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT2A receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50458557 (CHEMBL4215875) Show SMILES Cc1ccc(cc1)-c1noc2CCNCCc12 Show InChI InChI=1S/C14H16N2O/c1-10-2-4-11(5-3-10)14-12-6-8-15-9-7-13(12)17-16-14/h2-5,15H,6-9H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	147	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT1D receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2B (Homo sapiens (Human))	BDBM50458557 (CHEMBL4215875) Show SMILES Cc1ccc(cc1)-c1noc2CCNCCc12 Show InChI InChI=1S/C14H16N2O/c1-10-2-4-11(5-3-10)14-12-6-8-15-9-7-13(12)17-16-14/h2-5,15H,6-9H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	150	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT2B receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50458558 (CHEMBL4210782) Show SMILES Cc1ccc(cc1)-c1n[nH]c2CCNCCc12 Show InChI InChI=1S/C14H17N3/c1-10-2-4-11(5-3-10)14-12-6-8-15-9-7-13(12)16-17-14/h2-5,15H,6-9H2,1H3,(H,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	159	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT2A receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50458558 (CHEMBL4210782) Show SMILES Cc1ccc(cc1)-c1n[nH]c2CCNCCc12 Show InChI InChI=1S/C14H17N3/c1-10-2-4-11(5-3-10)14-12-6-8-15-9-7-13(12)16-17-14/h2-5,15H,6-9H2,1H3,(H,16,17)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	165	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT1D receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50458550 (CHEMBL4209274) Show SMILES Fc1ccc(cc1)-c1n[nH]c2CCNCCc12 Show InChI InChI=1S/C13H14FN3/c14-10-3-1-9(2-4-10)13-11-5-7-15-8-6-12(11)16-17-13/h1-4,15H,5-8H2,(H,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	175	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human 5-HT2A receptor expressed in HEK cell membranes after 1.5 hrs by microbeta scintillation counting method				J Med Chem 61: 7218-7233 (2018) Article DOI: 10.1021/acs.jmedchem.8b00642 BindingDB Entry DOI: 10.7270/Q2BC424N
					More data for this Ligand-Target Pair

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