Compile Data Set for Download or QSAR

Found 26 hits of kd for UniProtKB: P35961   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333274 (CHEMBL1645118 | N1-(4-chloro-3-fluorophenyl)-N2-(1...) Show SMILES CN1C(C)(C)CC(CC1(C)C)NC(=O)C(=O)Nc1ccc(Cl)c(F)c1 Show InChI InChI=1S/C18H25ClFN3O2/c1-17(2)9-12(10-18(3,4)23(17)5)22-16(25)15(24)21-11-6-7-13(19)14(20)8-11/h6-8,12H,9-10H2,1-5H3,(H,21,24)(H,22,25)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	300	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333233 (CHEMBL1645265 | N1-(4-chloro-3-fluorophenyl)-N2-(5...) Show SMILES Fc1cc(NC(=O)C(=O)NC2CCNC3(CCC3)C2)ccc1Cl Show InChI InChI=1S/C16H19ClFN3O2/c17-12-3-2-10(8-13(12)18)20-14(22)15(23)21-11-4-7-19-16(9-11)5-1-6-16/h2-3,8,11,19H,1,4-7,9H2,(H,20,22)(H,21,23)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333281 (CHEMBL1645111 | N1-(4-chloro-3-fluorophenyl)-N2-(2...) Show SMILES CC1(C)CC(CC(C)(C)N1)NC(=O)C(=O)Nc1ccc(Cl)c(F)c1 Show InChI InChI=1S/C17H23ClFN3O2/c1-16(2)8-11(9-17(3,4)22-16)21-15(24)14(23)20-10-5-6-12(18)13(19)7-10/h5-7,11,22H,8-9H2,1-4H3,(H,20,23)(H,21,24)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	760	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333263 (CHEMBL1645129 | N1-(4-chloro-3-fluorophenyl)-N2-(2...) Show SMILES CC1(C)CC(CC(C)(C)O1)NC(=O)C(=O)Nc1ccc(Cl)c(F)c1 Show InChI InChI=1S/C17H22ClFN2O3/c1-16(2)8-11(9-17(3,4)24-16)21-15(23)14(22)20-10-5-6-12(18)13(19)7-10/h5-7,11H,8-9H2,1-4H3,(H,20,22)(H,21,23)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333243 (CHEMBL1645256 | N1-(4-chloro-3-fluorophenyl)-N2-((...) Show SMILES Fc1cc(NC(=O)C(=O)NCC2NCCc3ccccc23)ccc1Cl Show InChI InChI=1S/C18H17ClFN3O2/c19-14-6-5-12(9-15(14)20)23-18(25)17(24)22-10-16-13-4-2-1-3-11(13)7-8-21-16/h1-6,9,16,21H,7-8,10H2,(H,22,24)(H,23,25)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333262 (4-(2-(4-chloro-3-fluorophenylamino)-2-oxoacetamido...) Show SMILES CC1(C)CC(CC(C)(C)[N+]1(C)[O-])NC(=O)C(=O)Nc1ccc(Cl)c(F)c1 |(20.21,-44.3,;18.73,-44.71,;19.49,-46.04,;17.41,-45.48,;16.08,-44.71,;16.06,-43.17,;17.4,-42.4,;16.62,-41.06,;18.16,-41.06,;18.74,-43.17,;19.49,-41.83,;20.27,-43.17,;14.75,-45.49,;13.41,-44.72,;13.4,-43.18,;12.08,-45.5,;12.09,-47.04,;10.74,-44.73,;9.41,-45.51,;8.08,-44.74,;6.75,-45.52,;6.75,-47.06,;5.41,-47.83,;8.08,-47.83,;8.08,-49.37,;9.42,-47.06,)| Show InChI InChI=1S/C18H25ClFN3O3/c1-17(2)9-12(10-18(3,4)23(17,5)26)22-16(25)15(24)21-11-6-7-13(19)14(20)8-11/h6-8,12H,9-10H2,1-5H3,(H,21,24)(H,22,25)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333232 (CHEMBL1645266 | N1-(4-chloro-3-fluorophenyl)-N2-(2...) Show SMILES C[C@H]1CCC[C@@H](C)N1CCNC(=O)C(=O)Nc1ccc(Cl)c(F)c1 |r| Show InChI InChI=1S/C17H23ClFN3O2/c1-11-4-3-5-12(2)22(11)9-8-20-16(23)17(24)21-13-6-7-14(18)15(19)10-13/h6-7,10-12H,3-5,8-9H2,1-2H3,(H,20,23)(H,21,24)/t11-,12+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333236 (CHEMBL1645262 | N1-(4-chloro-3-fluorophenyl)-N2-((...) Show SMILES Fc1cc(NC(=O)C(=O)NCC2CCN(C2)C2CC2)ccc1Cl Show InChI InChI=1S/C16H19ClFN3O2/c17-13-4-1-11(7-14(13)18)20-16(23)15(22)19-8-10-5-6-21(9-10)12-2-3-12/h1,4,7,10,12H,2-3,5-6,8-9H2,(H,19,22)(H,20,23)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333271 (CHEMBL1645121 | N1-(4-chloro-3-fluorophenyl)-N2-(1...) Show SMILES CC(C)N1CCC(CC1)NC(=O)C(=O)Nc1ccc(Cl)c(F)c1 Show InChI InChI=1S/C16H21ClFN3O2/c1-10(2)21-7-5-11(6-8-21)19-15(22)16(23)20-12-3-4-13(17)14(18)9-12/h3-4,9-11H,5-8H2,1-2H3,(H,19,22)(H,20,23)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333239 (CHEMBL1645259 | N1-(4-chloro-3-fluorophenyl)-N2-((...) Show SMILES CCN1CCCC1CNC(=O)C(=O)Nc1ccc(Cl)c(F)c1 Show InChI InChI=1S/C15H19ClFN3O2/c1-2-20-7-3-4-11(20)9-18-14(21)15(22)19-10-5-6-12(16)13(17)8-10/h5-6,8,11H,2-4,7,9H2,1H3,(H,18,21)(H,19,22)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333280 (CHEMBL1645112 | N1-(4-chloro-3-fluorophenyl)-N2-((...) Show SMILES CC1(C)CC(CNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)CC(C)(C)N1 Show InChI InChI=1S/C18H25ClFN3O2/c1-17(2)8-11(9-18(3,4)23-17)10-21-15(24)16(25)22-12-5-6-13(19)14(20)7-12/h5-7,11,23H,8-10H2,1-4H3,(H,21,24)(H,22,25)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333257 (CHEMBL1645242 | N1-(4-chloro-3-fluorophenyl)-N2-(2...) Show SMILES CC(C)N1CCCCC1CCNC(=O)C(=O)Nc1ccc(Cl)c(F)c1 Show InChI InChI=1S/C18H25ClFN3O2/c1-12(2)23-10-4-3-5-14(23)8-9-21-17(24)18(25)22-13-6-7-15(19)16(20)11-13/h6-7,11-12,14H,3-5,8-10H2,1-2H3,(H,21,24)(H,22,25)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333235 (CHEMBL1645263 | N1-(4-chloro-3-fluorophenyl)-N2-(1...) Show SMILES Fc1cc(NC(=O)C(=O)NC2CCN(C2)C2CCCCC2)ccc1Cl Show InChI InChI=1S/C18H23ClFN3O2/c19-15-7-6-12(10-16(15)20)21-17(24)18(25)22-13-8-9-23(11-13)14-4-2-1-3-5-14/h6-7,10,13-14H,1-5,8-9,11H2,(H,21,24)(H,22,25)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333259 (CHEMBL1645132 | N1-(4-chloro-3-fluorophenyl)-N2-((...) Show SMILES CN1CCCC(CNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)C1 Show InChI InChI=1S/C15H19ClFN3O2/c1-20-6-2-3-10(9-20)8-18-14(21)15(22)19-11-4-5-12(16)13(17)7-11/h4-5,7,10H,2-3,6,8-9H2,1H3,(H,18,21)(H,19,22)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333228 (CHEMBL1645270 | N1-(((4S,5S)-5-(aminomethyl)-2,2-d...) Show SMILES CC1(C)O[C@@H](CN)[C@H](CNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)O1 |r| Show InChI InChI=1S/C15H19ClFN3O4/c1-15(2)23-11(6-18)12(24-15)7-19-13(21)14(22)20-8-3-4-9(16)10(17)5-8/h3-5,11-12H,6-7,18H2,1-2H3,(H,19,21)(H,20,22)/t11-,12-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333268 (CHEMBL1645124 | N1-(4-chloro-3-fluorophenyl)-N2-(p...) Show SMILES Fc1cc(NC(=O)C(=O)NCC2CCNCC2)ccc1Cl Show InChI InChI=1S/C14H17ClFN3O2/c15-11-2-1-10(7-12(11)16)19-14(21)13(20)18-8-9-3-5-17-6-4-9/h1-2,7,9,17H,3-6,8H2,(H,18,20)(H,19,21)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	3.00E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333244 (CHEMBL1645255 | N1-(4-chloro-3-fluorophenyl)-N2-((...) Show SMILES Fc1cc(NC(=O)C(=O)NC[C@@]23CCC[C@@H]2CNC3)ccc1Cl |r| Show InChI InChI=1S/C16H19ClFN3O2/c17-12-4-3-11(6-13(12)18)21-15(23)14(22)20-9-16-5-1-2-10(16)7-19-8-16/h3-4,6,10,19H,1-2,5,7-9H2,(H,20,22)(H,21,23)/t10-,16+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333231 (CHEMBL1645267 | N1-(4-chloro-3-fluorophenyl)-N2-((...) Show SMILES OCCN1CCCC(CNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)C1 Show InChI InChI=1S/C16H21ClFN3O3/c17-13-4-3-12(8-14(13)18)20-16(24)15(23)19-9-11-2-1-5-21(10-11)6-7-22/h3-4,8,11,22H,1-2,5-7,9-10H2,(H,19,23)(H,20,24)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333261 (CHEMBL1641635 | N1-(4-chloro-3-fluorophenyl)-N2-(1...) Show SMILES CCCN1CCCC(C1)NC(=O)C(=O)Nc1ccc(Cl)c(F)c1 Show InChI InChI=1S/C16H21ClFN3O2/c1-2-7-21-8-3-4-12(10-21)20-16(23)15(22)19-11-5-6-13(17)14(18)9-11/h5-6,9,12H,2-4,7-8,10H2,1H3,(H,19,22)(H,20,23)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333266 (CHEMBL1645126 | N1-(4-chloro-3-fluorophenyl)-N2-((...) Show SMILES CCN1CCC(CNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)CC1 Show InChI InChI=1S/C16H21ClFN3O2/c1-2-21-7-5-11(6-8-21)10-19-15(22)16(23)20-12-3-4-13(17)14(18)9-12/h3-4,9,11H,2,5-8,10H2,1H3,(H,19,22)(H,20,23)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	3.40E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333241 (CHEMBL254781 | N-(4-chlorophenyl)-N'-(2,2,6,6-tetr...) Show SMILES CC1(C)CC(CC(C)(C)N1)NC(=O)C(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C17H24ClN3O2/c1-16(2)9-13(10-17(3,4)21-16)20-15(23)14(22)19-12-7-5-11(18)6-8-12/h5-8,13,21H,9-10H2,1-4H3,(H,19,22)(H,20,23)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	3.70E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333252 (CHEMBL1645247 | N1-(4-chloro-3-fluorophenyl)-N2-((...) Show SMILES Cc1n[nH]c(C)c1CNC(=O)C(=O)Nc1ccc(Cl)c(F)c1 Show InChI InChI=1S/C14H14ClFN4O2/c1-7-10(8(2)20-19-7)6-17-13(21)14(22)18-9-3-4-11(15)12(16)5-9/h3-5H,6H2,1-2H3,(H,17,21)(H,18,22)(H,19,20)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333272 (CHEMBL1645120 | N1-(4-chloro-3-fluorophenyl)-N2-(1...) Show SMILES CCCN1CCC(CC1)NC(=O)C(=O)Nc1ccc(Cl)c(F)c1 Show InChI InChI=1S/C16H21ClFN3O2/c1-2-7-21-8-5-11(6-9-21)19-15(22)16(23)20-12-3-4-13(17)14(18)10-12/h3-4,10-11H,2,5-9H2,1H3,(H,19,22)(H,20,23)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333260 (CHEMBL1645131 | N1-(4-chloro-3-fluorophenyl)-N2-(1...) Show SMILES CN1CCCC(C1)NC(=O)C(=O)Nc1ccc(Cl)c(F)c1 Show InChI InChI=1S/C14H17ClFN3O2/c1-19-6-2-3-10(8-19)18-14(21)13(20)17-9-4-5-11(15)12(16)7-9/h4-5,7,10H,2-3,6,8H2,1H3,(H,17,20)(H,18,21)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333267 (CHEMBL1645125 | N1-(4-chloro-3-fluorophenyl)-N2-((...) Show SMILES CN1CCC(CNC(=O)C(=O)Nc2ccc(Cl)c(F)c2)CC1 Show InChI InChI=1S/C15H19ClFN3O2/c1-20-6-4-10(5-7-20)9-18-14(21)15(22)19-11-2-3-12(16)13(17)8-11/h2-3,8,10H,4-7,9H2,1H3,(H,18,21)(H,19,22)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	4.30E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333273 (CHEMBL1645119 | N1-(4-chloro-3-fluorophenyl)-N2-(1...) Show SMILES CN1CCC(CC1)NC(=O)C(=O)Nc1ccc(Cl)c(F)c1 Show InChI InChI=1S/C14H17ClFN3O2/c1-19-6-4-9(5-7-19)17-13(20)14(21)18-10-2-3-11(15)12(16)8-10/h2-3,8-9H,4-7H2,1H3,(H,17,20)(H,18,21)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	9.40E+3	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assay				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair