Compile Data Set for Download or QSAR

Found 162 hits with Last Name = 'afonso' and Initial = 'a'   

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
Histamine H3 receptor (GUINEA PIG)	BDBM50071342 (4-Chloro-N-[4-(1H-imidazol-4-yl)-butyl]-N-(4-imida...) Show SMILES Clc1ccc(cc1)S(=O)(=O)N(CCCCc1cnc[nH]1)CCCCn1ccnc1 Show InChI InChI=1S/C20H26ClN5O2S/c21-18-6-8-20(9-7-18)29(27,28)26(12-2-1-5-19-15-23-16-24-19)13-4-3-11-25-14-10-22-17-25/h6-10,14-17H,1-5,11-13H2,(H,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071343 (4-Chloro-N-[4-(1H-imidazol-4-yl)-butyl]-N-methyl-b...) Show SMILES CN(CCCCc1cnc[nH]1)S(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C14H18ClN3O2S/c1-18(9-3-2-4-13-10-16-11-17-13)21(19,20)14-7-5-12(15)6-8-14/h5-8,10-11H,2-4,9H2,1H3,(H,16,17)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071348 (4-tert-Butyl-N-[5-(1H-imidazol-4-yl)-pentyl]-benze...) Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)NCCCCCc1cnc[nH]1 Show InChI InChI=1S/C18H27N3O2S/c1-18(2,3)15-8-10-17(11-9-15)24(22,23)21-12-6-4-5-7-16-13-19-14-20-16/h8-11,13-14,21H,4-7,12H2,1-3H3,(H,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071340 (CHEMBL68336 | N-[5-(1H-Imidazol-4-yl)-pentyl]-4-ni...) Show SMILES [O-][N+](=O)c1ccc(cc1)S(=O)(=O)NCCCCCc1cnc[nH]1 Show InChI InChI=1S/C14H18N4O4S/c19-18(20)13-5-7-14(8-6-13)23(21,22)17-9-3-1-2-4-12-10-15-11-16-12/h5-8,10-11,17H,1-4,9H2,(H,15,16)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071352 (CHEMBL69594 | N-[4-(1H-Imidazol-4-yl)-butyl]-C-phe...) Show SMILES O=S(=O)(Cc1ccccc1)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C14H19N3O2S/c18-20(19,11-13-6-2-1-3-7-13)17-9-5-4-8-14-10-15-12-16-14/h1-3,6-7,10,12,17H,4-5,8-9,11H2,(H,15,16)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071339 (CHEMBL68475 | N-[4-(1H-Imidazol-4-yl)-butyl]-4-tri...) Show SMILES FC(F)(F)Oc1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C14H16F3N3O3S/c15-14(16,17)23-12-4-6-13(7-5-12)24(21,22)20-8-2-1-3-11-9-18-10-19-11/h4-7,9-10,20H,1-3,8H2,(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071358 (3-Chloro-N-[4-(1H-imidazol-4-yl)-butyl]-benzenesul...) Show SMILES Clc1cccc(c1)S(=O)(=O)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C13H16ClN3O2S/c14-11-4-3-6-13(8-11)20(18,19)17-7-2-1-5-12-9-15-10-16-12/h3-4,6,8-10,17H,1-2,5,7H2,(H,15,16)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071346 (4-Chloro-N-[4-(1H-imidazol-4-yl)-butyl]-benzenesul...) Show SMILES Clc1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C13H16ClN3O2S/c14-11-4-6-13(7-5-11)20(18,19)17-8-2-1-3-12-9-15-10-16-12/h4-7,9-10,17H,1-3,8H2,(H,15,16)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071344 (CHEMBL71592 | N-[4-(1H-Imidazol-4-yl)-butyl]-4-tri...) Show SMILES FC(F)(F)c1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C14H16F3N3O2S/c15-14(16,17)11-4-6-13(7-5-11)23(21,22)20-8-2-1-3-12-9-18-10-19-12/h4-7,9-10,20H,1-3,8H2,(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071354 (CHEMBL69551 | N-[4-(1H-Imidazol-4-yl)-butyl]-benze...) Show SMILES O=S(=O)(NCCCCc1cnc[nH]1)c1ccccc1 Show InChI InChI=1S/C13H17N3O2S/c17-19(18,13-7-2-1-3-8-13)16-9-5-4-6-12-10-14-11-15-12/h1-3,7-8,10-11,16H,4-6,9H2,(H,14,15)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071336 (4-Chloro-N-[5-(1H-imidazol-4-yl)-pentyl]-benzenesu...) Show SMILES Clc1ccc(cc1)S(=O)(=O)NCCCCCc1cnc[nH]1 Show InChI InChI=1S/C14H18ClN3O2S/c15-12-5-7-14(8-6-12)21(19,20)18-9-3-1-2-4-13-10-16-11-17-13/h5-8,10-11,18H,1-4,9H2,(H,16,17)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071351 (CHEMBL69456 | N-[4-(1H-Imidazol-4-yl)-butyl]-4-met...) Show SMILES Cc1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C14H19N3O2S/c1-12-5-7-14(8-6-12)20(18,19)17-9-3-2-4-13-10-15-11-16-13/h5-8,10-11,17H,2-4,9H2,1H3,(H,15,16)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071337 (CHEMBL69607 | N-[4-(1H-Imidazol-4-yl)-butyl]-4-nit...) Show SMILES [O-][N+](=O)c1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C13H16N4O4S/c18-17(19)12-4-6-13(7-5-12)22(20,21)16-8-2-1-3-11-9-14-10-15-11/h4-7,9-10,16H,1-3,8H2,(H,14,15)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071356 (4-tert-Butyl-N-[4-(1H-imidazol-4-yl)-butyl]-benzen...) Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C17H25N3O2S/c1-17(2,3)14-7-9-16(10-8-14)23(21,22)20-11-5-4-6-15-12-18-13-19-15/h7-10,12-13,20H,4-6,11H2,1-3H3,(H,18,19)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071347 (4-Fluoro-N-[4-(1H-imidazol-4-yl)-butyl]-benzenesul...) Show SMILES Fc1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C13H16FN3O2S/c14-11-4-6-13(7-5-11)20(18,19)17-8-2-1-3-12-9-15-10-16-12/h4-7,9-10,17H,1-3,8H2,(H,15,16)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071338 (CHEMBL66439 | Propane-2-sulfonic acid [4-(1H-imida...) Show SMILES CC(C)S(=O)(=O)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C10H19N3O2S/c1-9(2)16(14,15)13-6-4-3-5-10-7-11-8-12-10/h7-9,13H,3-6H2,1-2H3,(H,11,12)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071359 (4-Chloro-N-(4-chloro-benzyl)-N-[4-(1H-imidazol-4-y...) Show SMILES Clc1ccc(CN(CCCCc2cnc[nH]2)S(=O)(=O)c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C20H21Cl2N3O2S/c21-17-6-4-16(5-7-17)14-25(12-2-1-3-19-13-23-15-24-19)28(26,27)20-10-8-18(22)9-11-20/h4-11,13,15H,1-3,12,14H2,(H,23,24)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071361 (CHEMBL71941 | N-[5-(1H-Imidazol-4-yl)-pentyl]-4-tr...) Show SMILES FC(F)(F)Oc1ccc(cc1)S(=O)(=O)NCCCCCc1cnc[nH]1 Show InChI InChI=1S/C15H18F3N3O3S/c16-15(17,18)24-13-5-7-14(8-6-13)25(22,23)21-9-3-1-2-4-12-10-19-11-20-12/h5-8,10-11,21H,1-4,9H2,(H,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	24	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071355 (CHEMBL69279 | N-[5-(1H-Imidazol-4-yl)-pentyl]-benz...) Show SMILES O=S(=O)(NCCCCCc1cnc[nH]1)c1ccccc1 Show InChI InChI=1S/C14H19N3O2S/c18-20(19,14-8-4-1-5-9-14)17-10-6-2-3-7-13-11-15-12-16-13/h1,4-5,8-9,11-12,17H,2-3,6-7,10H2,(H,15,16)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071363 (CHEMBL69682 | N-[4-(1H-Imidazol-4-yl)-butyl]-C-(2-...) Show SMILES [O-][N+](=O)c1ccccc1CS(=O)(=O)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C14H18N4O4S/c19-18(20)14-7-2-1-5-12(14)10-23(21,22)17-8-4-3-6-13-9-15-11-16-13/h1-2,5,7,9,11,17H,3-4,6,8,10H2,(H,15,16)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	42	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071350 (1-[4-(1H-Imidazol-4-yl)-butylsulfamoyl]-3-methyl-3...) Show SMILES Cn1cc[n+](c1)S(=O)(=O)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C11H18N5O2S/c1-15-6-7-16(10-15)19(17,18)14-5-3-2-4-11-8-12-9-13-11/h6-10,14H,2-5H2,1H3,(H,12,13)/q+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	43	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071349 (CHEMBL305174 | Thiophene-2-sulfonic acid [4-(1H-im...) Show SMILES O=S(=O)(NCCCCc1cnc[nH]1)c1cccs1 Show InChI InChI=1S/C11H15N3O2S2/c15-18(16,11-5-3-7-17-11)14-6-2-1-4-10-8-12-9-13-10/h3,5,7-9,14H,1-2,4,6H2,(H,12,13)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	45	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071353 (4-tert-Butyl-N-[3-(1H-imidazol-4-yl)-propyl]-benze...) Show SMILES CC(C)(C)c1ccc(cc1)S(=O)(=O)NCCCc1cnc[nH]1 Show InChI InChI=1S/C16H23N3O2S/c1-16(2,3)13-6-8-15(9-7-13)22(20,21)19-10-4-5-14-11-17-12-18-14/h6-9,11-12,19H,4-5,10H2,1-3H3,(H,17,18)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071362 (CHEMBL69044 | N-[4-(1H-Imidazol-4-yl)-butyl]-4-met...) Show SMILES COc1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C14H19N3O3S/c1-20-13-5-7-14(8-6-13)21(18,19)17-9-3-2-4-12-10-15-11-16-12/h5-8,10-11,17H,2-4,9H2,1H3,(H,15,16)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	51	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071357 (CHEMBL308899 | N-[3-(1H-Imidazol-4-yl)-propyl]-4-n...) Show SMILES [O-][N+](=O)c1ccc(cc1)S(=O)(=O)NCCCc1cnc[nH]1 Show InChI InChI=1S/C12H14N4O4S/c17-16(18)11-3-5-12(6-4-11)21(19,20)15-7-1-2-10-8-13-9-14-10/h3-6,8-9,15H,1-2,7H2,(H,13,14)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	93	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071360 (4-Amino-N-[4-(1H-imidazol-4-yl)-butyl]-benzenesulf...) Show SMILES Nc1ccc(cc1)S(=O)(=O)NCCCCc1cnc[nH]1 Show InChI InChI=1S/C13H18N4O2S/c14-11-4-6-13(7-5-11)20(18,19)17-8-2-1-3-12-9-15-10-16-12/h4-7,9-10,17H,1-3,8,14H2,(H,15,16)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	99	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071345 (4-Chloro-N-[3-(1H-imidazol-4-yl)-propyl]-benzenesu...) Show SMILES Clc1ccc(cc1)S(=O)(=O)NCCCc1cnc[nH]1 Show InChI InChI=1S/C12H14ClN3O2S/c13-10-3-5-12(6-4-10)19(17,18)16-7-1-2-11-8-14-9-15-11/h3-6,8-9,16H,1-2,7H2,(H,14,15)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	380	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Histamine H3 receptor (GUINEA PIG)	BDBM50071341 (CHEMBL69707 | Thiophene-2-sulfonic acid [3-(1H-imi...) Show SMILES O=S(=O)(NCCCc1cnc[nH]1)c1cccs1 Show InChI InChI=1S/C10H13N3O2S2/c14-17(15,10-4-2-6-16-10)13-5-1-3-9-7-11-8-12-9/h2,4,6-8,13H,1,3,5H2,(H,11,12)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	550	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-Nalpha-methylhistamine binding to H3 receptor in guinea-pig brain membranes				Bioorg Med Chem Lett 8: 2157-62 (1999) BindingDB Entry DOI: 10.7270/Q23T9GCZ
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079085 (5-(4-{2-[4-((R)-3,10-Dibromo-8-chloro-6,11-dihydro...) Show SMILES OC(=O)c1cncc(c1)C(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 Show InChI InChI=1S/C33H33Br2ClN4O4/c34-25-13-22-2-1-21-14-26(36)15-27(35)29(21)30(31(22)38-18-25)20-5-9-39(10-6-20)28(41)11-19-3-7-40(8-4-19)32(42)23-12-24(33(43)44)17-37-16-23/h12-20,30H,1-11H2,(H,43,44)/t30-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.800	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against Hras Farnesyltransferase (FPT).				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079090 (CHEMBL90435 | [(4-{2-[4-((R)-3,10-Dibromo-8-chloro...) Show SMILES OC(=O)CNC(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 Show InChI InChI=1S/C29H33Br2ClN4O4/c30-21-12-20-2-1-19-13-22(32)14-23(31)26(19)27(28(20)33-15-21)18-5-9-35(10-6-18)24(37)11-17-3-7-36(8-4-17)29(40)34-16-25(38)39/h12-15,17-18,27H,1-11,16H2,(H,34,40)(H,38,39)/t27-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	0.800	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against Hras Farnesyltransferase (FPT).				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079075 (4-{2-[4-((R)-3,10-Dibromo-8-chloro-6,11-dihydro-5H...) Show SMILES NC(=O)CNC(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 Show InChI InChI=1S/C29H34Br2ClN5O3/c30-21-12-20-2-1-19-13-22(32)14-23(31)26(19)27(28(20)34-15-21)18-5-9-36(10-6-18)25(39)11-17-3-7-37(8-4-17)29(40)35-16-24(33)38/h12-15,17-18,27H,1-11,16H2,(H2,33,38)(H,35,40)/t27-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	0.900	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-FPP incorporation into His6-H-Ras-CVLS by farnesyl transferase				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha (Homo sapiens (Human))	BDBM14457 ((+)-4-(8-Chloro-3,10-dibromo-6,11-dihydro-5H-benzo...) Show SMILES [O-][n+]1ccc(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)cc1 |r| Show InChI InChI=1S/C26H24Br2ClN3O2/c27-20-12-19-2-1-18-13-21(29)14-22(28)24(18)25(26(19)30-15-20)17-5-7-31(8-6-17)23(33)11-16-3-9-32(34)10-4-16/h3-4,9-10,12-15,17,25H,1-2,5-8,11H2/t25-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30	n/a	n/a	n/a	n/a	7.5	22
Schering-Plough Research Institute					Assay Description FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...				J Med Chem 41: 4890-902 (1998) Article DOI: 10.1021/jm980462b BindingDB Entry DOI: 10.7270/Q2ZS2TRS
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079079 (1-(4-{2-[4-((R)-3,10-Dibromo-8-chloro-6,11-dihydro...) Show SMILES Clc1cc(Br)c2[C@@H](C3CCN(CC3)C(=O)CC3CCN(CC3)C(=O)Cn3cncn3)c3ncc(Br)cc3CCc2c1 Show InChI InChI=1S/C30H33Br2ClN6O2/c31-23-12-22-2-1-21-13-24(33)14-25(32)28(21)29(30(22)35-15-23)20-5-9-37(10-6-20)26(40)11-19-3-7-38(8-4-19)27(41)16-39-18-34-17-36-39/h12-15,17-20,29H,1-11,16H2/t29-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.80	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against Hras Farnesyltransferase (FPT).				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha (Homo sapiens (Human))	BDBM14461 ((+)-4-(3,10-Dibromo-8-chloro-6,11-dihydro-5H-benzo...) Show SMILES [O-][n+]1ccc(CC(=O)N2CCN(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)cc1 |r| Show InChI InChI=1S/C25H23Br2ClN4O2/c26-19-12-18-2-1-17-13-20(28)14-21(27)23(17)25(24(18)29-15-19)31-9-7-30(8-10-31)22(33)11-16-3-5-32(34)6-4-16/h3-6,12-15,25H,1-2,7-11H2/t25-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80	n/a	n/a	n/a	n/a	7.5	22
Schering-Plough Research Institute					Assay Description FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...				J Med Chem 41: 4890-902 (1998) Article DOI: 10.1021/jm980462b BindingDB Entry DOI: 10.7270/Q2ZS2TRS
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM14459 ((+)-4-[2-[4-(8-Chloro-3,10-dibromo-6,11-dihydro-5H...) Show SMILES NC(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 |r| Show InChI InChI=1S/C27H31Br2ClN4O2/c28-20-12-19-2-1-18-13-21(30)14-22(29)24(18)25(26(19)32-15-20)17-5-9-33(10-6-17)23(35)11-16-3-7-34(8-4-16)27(31)36/h12-17,25H,1-11H2,(H2,31,36)/t25-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against Hras Farnesyltransferase (FPT).				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair				3D Structure (crystal)
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha (Homo sapiens (Human))	BDBM14459 ((+)-4-[2-[4-(8-Chloro-3,10-dibromo-6,11-dihydro-5H...) Show SMILES NC(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 |r| Show InChI InChI=1S/C27H31Br2ClN4O2/c28-20-12-19-2-1-18-13-21(30)14-22(29)24(18)25(26(19)32-15-20)17-5-9-33(10-6-17)23(35)11-16-3-7-34(8-4-16)27(31)36/h12-17,25H,1-11H2,(H2,31,36)/t25-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	1.90	n/a	n/a	n/a	n/a	7.5	22
Schering-Plough Research Institute					Assay Description FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...				J Med Chem 41: 4890-902 (1998) Article DOI: 10.1021/jm980462b BindingDB Entry DOI: 10.7270/Q2ZS2TRS
					More data for this Ligand-Target Pair				3D Structure (crystal)
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079074 (4-{2-[4-((R)-3,10-Dibromo-8-chloro-6,11-dihydro-5H...) Show SMILES CNC(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 Show InChI InChI=1S/C28H33Br2ClN4O2/c1-32-28(37)35-8-4-17(5-9-35)12-24(36)34-10-6-18(7-11-34)26-25-19(14-22(31)15-23(25)30)2-3-20-13-21(29)16-33-27(20)26/h13-18,26H,2-12H2,1H3,(H,32,37)/t26-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against Hras Farnesyltransferase (FPT).				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079089 (1-[4-((R)-3,10-Dibromo-8-chloro-6,11-dihydro-5H-be...) Show SMILES CS(=O)(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 Show InChI InChI=1S/C27H32Br2ClN3O3S/c1-37(35,36)33-10-4-17(5-11-33)12-24(34)32-8-6-18(7-9-32)26-25-19(14-22(30)15-23(25)29)2-3-20-13-21(28)16-31-27(20)26/h13-18,26H,2-12H2,1H3/t26-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against Hras Farnesyltransferase (FPT).				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079084 (CHEMBL432573 | [(4-{2-[4-((R)-3,10-Dibromo-8-chlor...) Show SMILES CCOC(=O)CNC(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 Show InChI InChI=1S/C31H37Br2ClN4O4/c1-2-42-27(40)18-36-31(41)38-9-5-19(6-10-38)13-26(39)37-11-7-20(8-12-37)29-28-21(15-24(34)16-25(28)33)3-4-22-14-23(32)17-35-30(22)29/h14-17,19-20,29H,2-13,18H2,1H3,(H,36,41)/t29-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against Hras Farnesyltransferase (FPT).				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079083 (1-[4-((R)-3,10-Dibromo-8-chloro-6,11-dihydro-5H-be...) Show SMILES [O-][n+]1cccc(c1)C(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 Show InChI InChI=1S/C32H33Br2ClN4O3/c33-25-15-23-4-3-22-16-26(35)17-27(34)29(22)30(31(23)36-18-25)21-7-12-37(13-8-21)28(40)14-20-5-10-38(11-6-20)32(41)24-2-1-9-39(42)19-24/h1-2,9,15-21,30H,3-8,10-14H2/t30-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.10	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of Hras Farnesyl protein transferase(FPT)				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079073 (2-(4-{2-[4-((R)-3,10-Dibromo-8-chloro-6,11-dihydro...) Show SMILES CN(C)C(=O)C(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 Show InChI InChI=1S/C30H35Br2ClN4O3/c1-35(2)29(39)30(40)37-9-5-18(6-10-37)13-25(38)36-11-7-19(8-12-36)27-26-20(15-23(33)16-24(26)32)3-4-21-14-22(31)17-34-28(21)27/h14-19,27H,3-13H2,1-2H3/t27-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.10	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against Hras Farnesyltransferase (FPT).				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079091 (2-(4-{2-[4-((R)-3,10-Dibromo-8-chloro-6,11-dihydro...) Show SMILES NC(=O)CN1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 Show InChI InChI=1S/C28H33Br2ClN4O2/c29-21-12-20-2-1-19-13-22(31)14-23(30)26(19)27(28(20)33-15-21)18-5-9-35(10-6-18)25(37)11-17-3-7-34(8-4-17)16-24(32)36/h12-15,17-18,27H,1-11,16H2,(H2,32,36)/t27-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.10	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of [3H]-FPP incorporation into His6-H-Ras-CVLS by farnesyl transferase				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079076 (5-(4-{2-[4-((R)-3,10-Dibromo-8-chloro-6,11-dihydro...) Show SMILES NC(=O)c1cncc(c1)C(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 Show InChI InChI=1S/C33H34Br2ClN5O3/c34-25-13-22-2-1-21-14-26(36)15-27(35)29(21)30(31(22)39-18-25)20-5-9-40(10-6-20)28(42)11-19-3-7-41(8-4-19)33(44)24-12-23(32(37)43)16-38-17-24/h12-20,30H,1-11H2,(H2,37,43)/t30-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.20	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against Hras Farnesyltransferase (FPT).				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha (Homo sapiens (Human))	BDBM14473 ((-)-1-(8-Chloro-3,7-dibromo-6,11-dihydro-5H-benzo-...) Show SMILES [O-][n+]1ccc(CC(=O)N2CCN(CC2)[C@H]2c3ccc(Cl)c(Br)c3CCc3cc(Br)cnc23)cc1 |r| Show InChI InChI=1S/C25H23Br2ClN4O2/c26-18-14-17-1-2-19-20(3-4-21(28)23(19)27)25(24(17)29-15-18)31-11-9-30(10-12-31)22(33)13-16-5-7-32(34)8-6-16/h3-8,14-15,25H,1-2,9-13H2/t25-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.30	n/a	n/a	n/a	n/a	7.5	22
Schering-Plough Research Institute					Assay Description FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...				J Med Chem 41: 4890-902 (1998) Article DOI: 10.1021/jm980462b BindingDB Entry DOI: 10.7270/Q2ZS2TRS
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079070 (1-[4-((R)-3,10-Dibromo-8-chloro-6,11-dihydro-5H-be...) Show SMILES [O-][n+]1ccc(cc1)C(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 Show InChI InChI=1S/C32H33Br2ClN4O3/c33-25-16-24-2-1-23-17-26(35)18-27(34)29(23)30(31(24)36-19-25)21-5-11-37(12-6-21)28(40)15-20-3-9-38(10-4-20)32(41)22-7-13-39(42)14-8-22/h7-8,13-14,16-21,30H,1-6,9-12,15H2/t30-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of Hras Farnesyl protein transferase(FPT)				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha (Homo sapiens (Human))	BDBM14467 ((+)-4-[2-[4-(8-Chloro-3,10-dibromo-6,11-dihydro-5H...) Show SMILES NC(=O)N1CCC(CC(=O)N2CCN(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 |r| Show InChI InChI=1S/C26H30Br2ClN5O2/c27-19-12-18-2-1-17-13-20(29)14-21(28)23(17)25(24(18)31-15-19)33-9-7-32(8-10-33)22(35)11-16-3-5-34(6-4-16)26(30)36/h12-16,25H,1-11H2,(H2,30,36)/t25-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.5	n/a	n/a	n/a	n/a	7.5	22
Schering-Plough Research Institute					Assay Description FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...				J Med Chem 41: 4890-902 (1998) Article DOI: 10.1021/jm980462b BindingDB Entry DOI: 10.7270/Q2ZS2TRS
					More data for this Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha (Homo sapiens (Human))	BDBM14469 ((-)-4-(8-Chloro-3,7-dibromo-6,11-dihydro-5H-benzo-...) Show SMILES [O-][n+]1ccc(CC(=O)N2CCC(CC2)[C@H]2c3ccc(Cl)c(Br)c3CCc3cc(Br)cnc23)cc1 |r| Show InChI InChI=1S/C26H24Br2ClN3O2/c27-19-14-18-1-2-21-20(3-4-22(29)25(21)28)24(26(18)30-15-19)17-7-9-31(10-8-17)23(33)13-16-5-11-32(34)12-6-16/h3-6,11-12,14-15,17,24H,1-2,7-10,13H2/t24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.60	n/a	n/a	n/a	n/a	7.5	22
Schering-Plough Research Institute					Assay Description FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...				J Med Chem 41: 4890-902 (1998) Article DOI: 10.1021/jm980462b BindingDB Entry DOI: 10.7270/Q2ZS2TRS
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079086 (3-(4-{2-[4-((R)-3,10-Dibromo-8-chloro-6,11-dihydro...) Show SMILES Clc1cc(Br)c2[C@@H](C3CCN(CC3)C(=O)CC3CCN(CC3)C(=O)CC#N)c3ncc(Br)cc3CCc2c1 Show InChI InChI=1S/C29H31Br2ClN4O2/c30-22-14-21-2-1-20-15-23(32)16-24(31)27(20)28(29(21)34-17-22)19-6-11-36(12-7-19)26(38)13-18-4-9-35(10-5-18)25(37)3-8-33/h14-19,28H,1-7,9-13H2/t28-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.60	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibition of Hras Farnesyl protein transferase(FPT)				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Dimer of Protein farnesyltransferase subunit beta (Homo sapiens (Human))	BDBM50079077 (2-(4-{2-[4-((R)-3,10-Dibromo-8-chloro-6,11-dihydro...) Show SMILES NC(=O)C(=O)N1CCC(CC(=O)N2CCC(CC2)[C@H]2c3ncc(Br)cc3CCc3cc(Cl)cc(Br)c23)CC1 Show InChI InChI=1S/C28H31Br2ClN4O3/c29-20-12-19-2-1-18-13-21(31)14-22(30)24(18)25(26(19)33-15-20)17-5-9-34(10-6-17)23(36)11-16-3-7-35(8-4-16)28(38)27(32)37/h12-17,25H,1-11H2,(H2,32,37)/t25-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Inhibitory activity against Hras Farnesyltransferase (FPT).				J Med Chem 42: 2651-61 (1999) Article DOI: 10.1021/jm990059k BindingDB Entry DOI: 10.7270/Q2ST7P2V
					More data for this Ligand-Target Pair
Protein farnesyltransferase subunit beta/geranylgeranyltransferase type-1 subunit alpha (Homo sapiens (Human))	BDBM14477 ((-)-4-[2-[4-(3,7-Dibromo-8-chloro-6,11-dihydro-5Hb...) Show SMILES NC(=O)N1CCC(CC(=O)N2CCN(CC2)[C@H]2c3ccc(Cl)c(Br)c3CCc3cc(Br)cnc23)CC1 |r| Show InChI InChI=1S/C26H30Br2ClN5O2/c27-18-14-17-1-2-19-20(3-4-21(29)23(19)28)25(24(17)31-15-18)33-11-9-32(10-12-33)22(35)13-16-5-7-34(8-6-16)26(30)36/h3-4,14-16,25H,1-2,5-13H2,(H2,30,36)/t25-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.10	n/a	n/a	n/a	n/a	7.5	22
Schering-Plough Research Institute					Assay Description FPT activity was determined by measuring transfer of [3H] farnesyl from [3H]farnesyl pyrophosphate to the substrate His6-Ha-Ras-CVLS. The incorporate...				J Med Chem 41: 4890-902 (1998) Article DOI: 10.1021/jm980462b BindingDB Entry DOI: 10.7270/Q2ZS2TRS
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 162 total )  |  Next  |  Last  >>

Jump to: