Compile Data Set for Download or QSAR

Found 82 hits with Last Name = 'fukunaga' and Initial = 't'   

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
Galanin receptor type 1 (RAT)	BDBM50149871 ((R)-2-((3-(biphenyl-4-yloxy)-3-(4-fluorophenyl)pro...) Show SMILES CN(CC[C@@H](Oc1ccc(cc1)-c1ccccc1)c1ccc(F)cc1)CC(O)=O |r| Show InChI InChI=1S/C24H24FNO3/c1-26(17-24(27)28)16-15-23(20-7-11-21(25)12-8-20)29-22-13-9-19(10-14-22)18-5-3-2-4-6-18/h2-14,23H,15-17H2,1H3,(H,27,28)/t23-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 1 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair
Galanin receptor type 1 (RAT)	BDBM50256665 ((3S,6S,9S,12S)-3-benzyl-9,12-di-sec-butyl-6-((2S,3...) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@@H](C)CC)[C@H](C)[C@@H](C)O |r| Show InChI InChI=1S/C27H42N4O5/c1-7-15(3)21-25(34)30-22(16(4)8-2)26(35)31-23(17(5)18(6)32)27(36)28-20(24(33)29-21)14-19-12-10-9-11-13-19/h9-13,15-18,20-23,32H,7-8,14H2,1-6H3,(H,28,36)(H,29,33)(H,30,34)(H,31,35)/t15-,16-,17+,18+,20-,21-,22-,23-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 1 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591500 (CHEMBL5195099) Show SMILES N#Cc1ccc(COc2ccc(nc2)-c2ccn[nH]2)cc1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Beta-glucuronidase (Homo sapiens (Human))	BDBM50405568 (CHEMBL5273557) Show SMILES OCCC[n+]1ccc(\C=C\c2cccc3ccccc23)cc1 Show InChI InChI=1S/C20H20NO/c22-16-4-13-21-14-11-17(12-15-21)9-10-19-7-3-6-18-5-1-2-8-20(18)19/h1-3,5-12,14-15,22H,4,13,16H2/q+1/b10-9+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars		n/a	n/a	9.80	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description In vitro concentration required to inhibit partially purified dihydropteroate synthase of Escherichia coli by 50%				Citation and Details
					More data for this Ligand-Target Pair
Galanin receptor type 1 (RAT)	BDBM50256666 ((3S,6S,9S,12S)-3-benzyl-12-sec-butyl-6-((2S,3R)-3-...) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)C(C)C)[C@H](C)[C@@H](C)O |r| Show InChI InChI=1S/C26H40N4O5/c1-7-15(4)21-25(34)28-20(14(2)3)24(33)30-22(16(5)17(6)31)26(35)27-19(23(32)29-21)13-18-11-9-8-10-12-18/h8-12,14-17,19-22,31H,7,13H2,1-6H3,(H,27,35)(H,28,34)(H,29,32)(H,30,33)/t15-,16+,17+,19-,20-,21-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10.2	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 1 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair
Galanin receptor type 1 (RAT)	BDBM50256705 ((3S,6S,9S,12S)-3-benzyl-6-((2S,3R)-3-hydroxybutan-...) Show SMILES CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)C(C)C)[C@H](C)[C@@H](C)O |r| Show InChI InChI=1S/C25H38N4O5/c1-13(2)19-23(32)28-20(14(3)4)24(33)29-21(15(5)16(6)30)25(34)26-18(22(31)27-19)12-17-10-8-7-9-11-17/h7-11,13-16,18-21,30H,12H2,1-6H3,(H,26,34)(H,27,31)(H,28,32)(H,29,33)/t15-,16-,18+,19+,20+,21+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11.1	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 1 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair
Galanin receptor type 1 (RAT)	BDBM50256704 ((3S,6S,9S,12S)-3-benzyl-9-sec-butyl-6-((2S,3R)-3-h...) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC1=O)[C@H](C)[C@@H](C)O)C(C)C |r| Show InChI InChI=1S/C26H40N4O5/c1-7-15(4)21-25(34)30-22(16(5)17(6)31)26(35)27-19(13-18-11-9-8-10-12-18)23(32)28-20(14(2)3)24(33)29-21/h8-12,14-17,19-22,31H,7,13H2,1-6H3,(H,27,35)(H,28,32)(H,29,33)(H,30,34)/t15-,16+,17+,19-,20-,21-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11.4	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 1 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591501 (CHEMBL5183418) Show SMILES N#Cc1cccc(COc2ccc(nc2)-c2ccn[nH]2)c1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	15	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591496 (CHEMBL5204432) Show SMILES Cc1ncsc1CCOc1ccc(cc1)-c1ccn[nH]1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591519 (CHEMBL5174407) Show SMILES CN(C)C(=O)N1CCC(COc2ccc(nc2)-c2ccn[nH]2)CC1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591496 (CHEMBL5204432) Show SMILES Cc1ncsc1CCOc1ccc(cc1)-c1ccn[nH]1 Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Galanin receptor type 1 (RAT)	BDBM50256664 ((S)-2-((2S,5S,8S,11S)-5-benzyl-8,11-di-sec-butyl-3...) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@@H](C)CC)[C@H](CS(O)(=O)=O)C(C)=O |r| Show InChI InChI=1S/C27H40N4O8S/c1-6-15(3)21-25(34)30-22(16(4)7-2)26(35)31-23(19(17(5)32)14-40(37,38)39)27(36)28-20(24(33)29-21)13-18-11-9-8-10-12-18/h8-12,15-16,19-23H,6-7,13-14H2,1-5H3,(H,28,36)(H,29,33)(H,30,34)(H,31,35)(H,37,38,39)/t15-,16-,19+,20-,21-,22-,23-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	20.4	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 1 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591499 (CHEMBL5173608) Show SMILES Fc1ccc(COc2ccc(nc2)-c2ccn[nH]2)cc1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Galanin receptor type 2 (RAT)	BDBM50256745 ((2S)-2-amino-3-((2-(benzyloxy)phenyl)(3-fluorophen...) Show SMILES N[C@@H](COC(c1cccc(F)c1)c1ccccc1OCc1ccccc1)C(O)=O |r| Show InChI InChI=1S/C23H22FNO4/c24-18-10-6-9-17(13-18)22(29-15-20(25)23(26)27)19-11-4-5-12-21(19)28-14-16-7-2-1-3-8-16/h1-13,20,22H,14-15,25H2,(H,26,27)/t20-,22?/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	21.1	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 2 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591520 (CHEMBL5169535) Show SMILES CN(C)S(=O)(=O)N1CCC[C@H](COc2ccc(nc2)-c2ccn[nH]2)C1 |r| Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Galanin receptor type 1 (RAT)	BDBM50256706 ((3S,6S,9S,12S)-3-benzyl-6,9,12-tri-sec-butyl-1,4,7...) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@@H](C)CC)[C@@H](C)CC |r| Show InChI InChI=1S/C27H42N4O4/c1-7-16(4)21-25(33)28-20(15-19-13-11-10-12-14-19)24(32)29-22(17(5)8-2)26(34)31-23(18(6)9-3)27(35)30-21/h10-14,16-18,20-23H,7-9,15H2,1-6H3,(H,28,33)(H,29,32)(H,30,35)(H,31,34)/t16-,17-,18-,20-,21-,22-,23-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	29.6	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 1 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591520 (CHEMBL5169535) Show SMILES CN(C)S(=O)(=O)N1CCC[C@H](COc2ccc(nc2)-c2ccn[nH]2)C1 |r| Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591505 (CHEMBL5199278) Show SMILES CS(=O)(=O)N1CCC[C@@H](COc2ccc(nc2)-c2ccn[nH]2)C1 |r| Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591510 (CHEMBL5206230) Show SMILES CC(=O)N1CCC(COc2ccc(nc2)-c2ccn[nH]2)CC1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591506 (CHEMBL5189943) Show SMILES CS(=O)(=O)N1CCC[C@H](COc2ccc(nc2)-c2ccn[nH]2)C1 |r| Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	41	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591497 (CHEMBL5192170) Show SMILES Cc1ncsc1CCOc1ccc(nc1)-c1ccn[nH]1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591502 (CHEMBL5205521) Show SMILES CS(=O)(=O)c1cccc(COc2ccc(nc2)-c2ccn[nH]2)c1 Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591518 (CHEMBL5172100) Show SMILES CNC(=O)N1CCC(COc2ccc(nc2)-c2ccn[nH]2)CC1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	63	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591498 (CHEMBL5180285) Show SMILES Cc1ncsc1CCOc1cnc(nc1)-c1ccn[nH]1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	66	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591504 (CHEMBL5208981) Show SMILES CS(=O)(=O)c1cc(O)cc(COc2ccc(nc2)-c2ccn[nH]2)c1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	69	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591508 (CHEMBL5192567) Show SMILES CC(=O)N1CCC[C@@H](COc2ccc(nc2)-c2ccn[nH]2)C1 |r| Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591517 (CHEMBL5183091) Show SMILES COC(=O)N1CCC(COc2ccc(nc2)-c2ccn[nH]2)CC1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	73	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Galanin receptor type 2 (RAT)	BDBM50256746 ((3S,6S,9S,15aR)-9-sec-butyl-6-((1-methoxy-1H-indol...) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2cn(OC)c3ccccc23)NC(=O)[C@H](CCCCC(C)=O)NC(=O)[C@H]2CCCCN2C1=O |r| Show InChI InChI=1S/C32H45N5O6/c1-5-20(2)28-32(42)36-17-11-10-16-27(36)31(41)33-24(14-8-6-12-21(3)38)29(39)34-25(30(40)35-28)18-22-19-37(43-4)26-15-9-7-13-23(22)26/h7,9,13,15,19-20,24-25,27-28H,5-6,8,10-12,14,16-18H2,1-4H3,(H,33,41)(H,34,39)(H,35,40)/t20-,24-,25-,27+,28-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	87.7	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 2 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair
Galanin receptor type 1 (RAT)	BDBM50256746 ((3S,6S,9S,15aR)-9-sec-butyl-6-((1-methoxy-1H-indol...) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2cn(OC)c3ccccc23)NC(=O)[C@H](CCCCC(C)=O)NC(=O)[C@H]2CCCCN2C1=O |r| Show InChI InChI=1S/C32H45N5O6/c1-5-20(2)28-32(42)36-17-11-10-16-27(36)31(41)33-24(14-8-6-12-21(3)38)29(39)34-25(30(40)35-28)18-22-19-37(43-4)26-15-9-7-13-23(22)26/h7,9,13,15,19-20,24-25,27-28H,5-6,8,10-12,14,16-18H2,1-4H3,(H,33,41)(H,34,39)(H,35,40)/t20-,24-,25-,27+,28-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	94.6	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 1 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591503 (CHEMBL5195431) Show SMILES CS(=O)(=O)c1ccc(COc2ccc(nc2)-c2ccn[nH]2)cc1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	96	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591516 (CHEMBL5199197) Show SMILES O=C(C1CC1)N1CCC(COc2ccc(nc2)-c2ccn[nH]2)CC1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591510 (CHEMBL5206230) Show SMILES CC(=O)N1CCC(COc2ccc(nc2)-c2ccn[nH]2)CC1 Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591497 (CHEMBL5192170) Show SMILES Cc1ncsc1CCOc1ccc(nc1)-c1ccn[nH]1 Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591514 (CHEMBL5184859) Show SMILES CC(=O)N[C@@H]1CC[C@H](COc2ccc(nc2)-c2ccn[nH]2)CC1 |r,wU:7.7,4.3,(-8.55,-3.62,;-7.22,-2.85,;-7.22,-1.31,;-5.88,-3.62,;-4.55,-2.85,;-3.22,-3.62,;-1.89,-2.86,;-1.89,-1.32,;-.55,-.55,;.78,-1.32,;2.12,-.55,;3.45,-1.31,;4.78,-.54,;4.78,1,;3.45,1.77,;2.12,1,;6.11,1.77,;7.52,1.14,;8.55,2.29,;7.78,3.62,;6.27,3.3,;-3.22,-.54,;-4.55,-1.32,)| Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591509 (CHEMBL5191778) Show SMILES CC(=O)N1CCC[C@H](COc2ccc(nc2)-c2ccn[nH]2)C1 |r| Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591504 (CHEMBL5208981) Show SMILES CS(=O)(=O)c1cc(O)cc(COc2ccc(nc2)-c2ccn[nH]2)c1 Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591509 (CHEMBL5191778) Show SMILES CC(=O)N1CCC[C@H](COc2ccc(nc2)-c2ccn[nH]2)C1 |r| Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591515 (CHEMBL5203135) Show SMILES CC(=O)N[C@H]1CC[C@H](COc2ccc(nc2)-c2ccn[nH]2)CC1 |r,wU:7.7,wD:4.3,(-8.55,-3.62,;-7.22,-2.85,;-7.22,-1.31,;-5.88,-3.62,;-4.55,-2.85,;-3.22,-3.62,;-1.89,-2.86,;-1.89,-1.32,;-.55,-.55,;.78,-1.32,;2.12,-.55,;3.45,-1.31,;4.78,-.54,;4.78,1,;3.45,1.77,;2.12,1,;6.11,1.77,;7.52,1.14,;8.55,2.29,;7.78,3.62,;6.27,3.3,;-3.22,-.54,;-4.55,-1.32,)| Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	220	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Galanin receptor type 2 (RAT)	BDBM50256706 ((3S,6S,9S,12S)-3-benzyl-6,9,12-tri-sec-butyl-1,4,7...) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@@H](C)CC)[C@@H](C)CC |r| Show InChI InChI=1S/C27H42N4O4/c1-7-16(4)21-25(33)28-20(15-19-13-11-10-12-14-19)24(32)29-22(17(5)8-2)26(34)31-23(18(6)9-3)27(35)30-21/h10-14,16-18,20-23H,7-9,15H2,1-6H3,(H,28,33)(H,29,32)(H,30,35)(H,31,34)/t16-,17-,18-,20-,21-,22-,23-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	226	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 2 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591502 (CHEMBL5205521) Show SMILES CS(=O)(=O)c1cccc(COc2ccc(nc2)-c2ccn[nH]2)c1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591498 (CHEMBL5180285) Show SMILES Cc1ncsc1CCOc1cnc(nc1)-c1ccn[nH]1 Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Galanin receptor type 2 (RAT)	BDBM50256665 ((3S,6S,9S,12S)-3-benzyl-9,12-di-sec-butyl-6-((2S,3...) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)[C@@H](C)CC)[C@H](C)[C@@H](C)O |r| Show InChI InChI=1S/C27H42N4O5/c1-7-15(3)21-25(34)30-22(16(4)8-2)26(35)31-23(17(5)18(6)32)27(36)28-20(24(33)29-21)14-19-12-10-9-11-13-19/h9-13,15-18,20-23,32H,7-8,14H2,1-6H3,(H,28,36)(H,29,33)(H,30,34)(H,31,35)/t15-,16-,17+,18+,20-,21-,22-,23-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	278	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 2 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591517 (CHEMBL5183091) Show SMILES COC(=O)N1CCC(COc2ccc(nc2)-c2ccn[nH]2)CC1 Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591499 (CHEMBL5173608) Show SMILES Fc1ccc(COc2ccc(nc2)-c2ccn[nH]2)cc1 Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	370	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591501 (CHEMBL5183418) Show SMILES N#Cc1cccc(COc2ccc(nc2)-c2ccn[nH]2)c1 Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591514 (CHEMBL5184859) Show SMILES CC(=O)N[C@@H]1CC[C@H](COc2ccc(nc2)-c2ccn[nH]2)CC1 |r,wU:7.7,4.3,(-8.55,-3.62,;-7.22,-2.85,;-7.22,-1.31,;-5.88,-3.62,;-4.55,-2.85,;-3.22,-3.62,;-1.89,-2.86,;-1.89,-1.32,;-.55,-.55,;.78,-1.32,;2.12,-.55,;3.45,-1.31,;4.78,-.54,;4.78,1,;3.45,1.77,;2.12,1,;6.11,1.77,;7.52,1.14,;8.55,2.29,;7.78,3.62,;6.27,3.3,;-3.22,-.54,;-4.55,-1.32,)| Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	410	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Galanin receptor type 2 (RAT)	BDBM50256704 ((3S,6S,9S,12S)-3-benzyl-9-sec-butyl-6-((2S,3R)-3-h...) Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC1=O)[C@H](C)[C@@H](C)O)C(C)C |r| Show InChI InChI=1S/C26H40N4O5/c1-7-15(4)21-25(34)30-22(16(5)17(6)31)26(35)27-19(13-18-11-9-8-10-12-18)23(32)28-20(14(2)3)24(33)29-21/h8-12,14-17,19-22,31H,7,13H2,1-6H3,(H,27,35)(H,28,32)(H,29,33)(H,30,34)/t15-,16+,17+,19-,20-,21-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	450	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 2 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair
Cytochrome P450 4F2 (Homo sapiens (Human))	BDBM50591495 (CHEMBL5181522) Show SMILES CCOC(=O)N1CCN(CCOc2ccc(cc2)-c2ccn[nH]2)CC1 Show InChI	UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	510	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Cytochrome P450 4A11 (Homo sapiens)	BDBM50591516 (CHEMBL5199197) Show SMILES O=C(C1CC1)N1CCC(COc2ccc(nc2)-c2ccn[nH]2)CC1 Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	530	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acs.jmedchem.2c01089 BindingDB Entry DOI: 10.7270/Q2MK6HW6
					More data for this Ligand-Target Pair
Galanin receptor type 2 (RAT)	BDBM50256705 ((3S,6S,9S,12S)-3-benzyl-6-((2S,3R)-3-hydroxybutan-...) Show SMILES CC(C)[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)C(C)C)[C@H](C)[C@@H](C)O |r| Show InChI InChI=1S/C25H38N4O5/c1-13(2)19-23(32)28-20(14(3)4)24(33)29-21(15(5)16(6)30)25(34)26-18(22(31)27-19)12-17-10-8-7-9-11-17/h7-11,13-16,18-21,30H,12H2,1-6H3,(H,26,34)(H,27,31)(H,28,32)(H,29,33)/t15-,16-,18+,19+,20+,21+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	542	n/a	n/a	n/a	n/a	n/a	n/a
Taisho Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of [3H]glycine uptake at rat glycine transporter 2 expressed in african green monkey COS7 cells				Bioorg Med Chem Lett 18: 6321-3 (2008) Article DOI: 10.1016/j.bmcl.2008.10.104 BindingDB Entry DOI: 10.7270/Q2BZ65WC
					More data for this Ligand-Target Pair

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