cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2b8569w
title: BindingDB Entry 159: Substituted pyrazolo[1,5-a]pyrazines as negative allosteric modulators of metabotropic glutamate receptor 3

description: Small molecule binding data for protein Metabotropic glutamate receptor 3 (mGlu3) and Metabotropic glutamate receptor 5 (mGlu5), Uniprot P31422 and P31424
DOI: 10.7270/q2g15z17
title: BindingDB Entry 158: Compounds useful for producing an optically active diazabicyclooctane compound

description: Small molecule binding data for protein beta-Lactamase, Uniprot P24735
DOI: 10.7270/q2ks6pr7
title: BindingDB Entry 157: Azole derivative

description: Small molecule binding data for protein Vasopressin V1b receptor, Uniprot P47901
DOI: 10.7270/q2qj7fhd
title: BindingDB Entry 156: Fused heterocyclic derivatives as S1P modulators

description: Small molecule binding data for protein Sphingosine 1-Phosphate Receptor 5, Sphingosine 1-phosphate receptor, and Sphingosine 1-phosphate receptor 3, Uniprot P21453, Q99500, and Q9H228
DOI: 10.7270/q2v98674
title: BindingDB Entry 155: Cannabinoid-2 agonists

description: Small molecule binding data for protein Cannabinoid receptor 1 and Cannabinoid receptor 2, Uniprot P21554 and P34972
DOI: 10.7270/q22r3pvf
title: BindingDB Entry 162: Pharmacologically active compounds

description: Small molecule binding data for protein Glycine receptor subunit alpha-1, Uniprot P23415
DOI: 10.7270/q2f18wwf
title: BindingDB Entry 167: Fused tricyclic amide compounds as multiple kinase inhibitors

description: Small molecule binding data for protein B-RAF V600E, C-RAF, Epidermal growth factor receptor, Epidermal growth factor receptor(L858R), and Epidermal growth factor receptor(L858R, T790M), Uniprot P00533 and P04049
DOI: 10.7270/q2js9nmv
title: BindingDB Entry 166: Heteroaryl compounds and methods of use thereof

description: Small molecule binding data for protein cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, Uniprot Q9Y233
DOI: 10.7270/q2pk0db4
title: BindingDB Entry 165: 5-HT3 receptor antagonists

description: Small molecule binding data for protein Serotonin 3 (5-HT3) receptor, Uniprot P46098
DOI: 10.7270/q2tb1539
title: BindingDB Entry 164: Toll-like receptor 2-agonistic lipopeptides, and method of making the same

description: Small molecule binding data for protein Toll-like receptor 2 (TLR2), Uniprot O60603
DOI: 10.7270/q2z31wt7
title: BindingDB Entry 163: Pyrimido-diazepinone compounds and methods of treating disorders

description: Small molecule binding data for protein Extracellular signal-regulated kinase 5 (ERK5) and Leucine-rich repeat serine/threonine-protein kinase 2 G2019S, Uniprot Q13164
DOI: 10.7270/q21v5c4s
title: BindingDB Entry 170: Fused thiazin-3-ones as KCA3.1 inhibitors

description: Small molecule binding data for protein Intermediate conductance calcium-activated potassium channel protein 4, Uniprot O15554
DOI: 10.7270/q25h7dfs
title: BindingDB Entry 169: Substituted N-heteroaryl spirolactam bipyrrolidines, preparation and therapeutic use thereof

description: Small molecule binding data for protein Histamine receptor H3, Uniprot Q865E1
DOI: 10.7270/q298855h
title: BindingDB Entry 168: Modified biotin, mutant streptavidin, and use thereof

description: Small molecule binding data for protein LISA-314 and LISA-314 V21
DOI: 10.7270/q2d21vrm
title: BindingDB Entry 175: Pyrrole six-membered heteroaryl ring derivative, preparation method thereof, and medicinal uses thereof

description: Small molecule binding data for protein JAK2, JAK3, and Tyrosine-protein kinase JAK1, Uniprot O60674, P23458, and P52333
DOI: 10.7270/q2nk3c6r
title: BindingDB Entry 173: Substituted spirocycles

description: Small molecule binding data for protein inhibition of dppi , Uniprot P53634
DOI: 10.7270/q2sb43x2
title: BindingDB Entry 172: Benzimidazole tetrahydrofuran derivatives

description: Small molecule binding data for protein 5'-AMP-activated protein kinase catalytic subunit alpha-1, Uniprot Q13131
DOI: 10.7270/q2x34vnd
title: BindingDB Entry 171: Substituted 1,7-naphthyridines as dopamine D1 ligands

description: Small molecule binding data for protein Dopamine D1 receptor, Uniprot P21728
DOI: 10.7270/q20v8b0d
title: BindingDB Entry 178: P2X7 modulators

description: Small molecule binding data for protein P2X purinoceptor 7 and P2X purinoceptor 7 (P2X7), Uniprot Q64663 and Q99572
DOI: 10.7270/q24m92qq
title: BindingDB Entry 177: 15-aryl prostaglandins as EP4 agonists, and methods of use thereof

description: Small molecule binding data for protein Prostaglandin E2 receptor EP2 subtype (EP2) and Prostaglandin E2 receptor EP4 subtype (EP4), Uniprot P35408 and P43116
DOI: 10.7270/q289141p
title: BindingDB Entry 176: 7-hydroxy-indolinyl antagonists of P2Y1 receptor

description: Small molecule binding data for protein Purinergic receptor P2Y1, Uniprot P47900
DOI: 10.7270/q2gt5kbn
title: BindingDB Entry 182: 6-arylamino pyridone carboxamide as MEK inhibitors

description: Small molecule binding data for protein Dual specificity mitogen-activated protein kinase kinase 1, Uniprot Q02750
DOI: 10.7270/q2ht2mg1
title: BindingDB Entry 174: Pyrrolidino heterocycles

description: Small molecule binding data for protein cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, Uniprot Q9Y233
DOI: 10.7270/q2mk6b2c
title: BindingDB Entry 181: HSPC-sparing treatments for RB-positive abnormal cellular proliferation

description: Small molecule binding data for protein CDK2/CycE, Cyclin-Dependent Kinase 2 (CDK2), and Cyclin-Dependent Kinase 4 (CDK4), Uniprot P11802, P20248, P24385, P24864, and P24941
DOI: 10.7270/q2rb72sp
title: BindingDB Entry 180: (1,2,4)triazolo[4,3-A]quinoxaline derivatives as inhibitors of phosphodiesterases

description: Small molecule binding data for protein cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A and cGMP-dependent 3',5'-cyclic phosphodiesterase, Uniprot O00408 and Q9Y233
DOI: 10.7270/q2w37th1
title: BindingDB Entry 179: Dihydro-benzo-oxazine and dihydro-pyrido-oxazine derivatives

description: Small molecule binding data for protein Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform and Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, Uniprot O00329 and P42336
DOI: 10.7270/q23n21kw
title: BindingDB Entry 185: Dihydropyrido pyrimidine compounds as autotaxin inhibitors

description: Small molecule binding data for protein Autotaxin, Uniprot Q13822
DOI: 10.7270/q27d2s97
title: BindingDB Entry 184: Complement pathway modulators and uses thereof

description: Small molecule binding data for protein human factor d , Uniprot P00746
DOI: 10.7270/q2c24tm7
title: BindingDB Entry 183: ERK inhibitors

description: Small molecule binding data for protein MAP kinase ERK2, Uniprot P28482
DOI: 10.7270/q2ft8j7q
title: BindingDB Entry 289: Aza-Peptide Analogs as Potent Human Immunodeficiency Virus Type-1 Protease Inhibitors with Oral Bioavailability

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2kk98z1
title: BindingDB Entry 288: Influence of stereochemistry on activity and binding modes for C2 symmetry-based diol inhibitors of HIV-1 protease

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2qc01nv
title: BindingDB Entry 287: Design, activity, and 2.8 A crystal structure of a C2 symmetric inhibitor complexed to HIV-1 protease

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2v40sc6
title: BindingDB Entry 286: A Novel Picomolar Inhibitor of HIV-1 Protease

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2zw1j3m
title: BindingDB Entry 285: Cyclic HIV protease inhibitors: synthesis, conformational analysis, P2/P2' structure-activity relationship, and molecular recognition of cyclic ureas.

description: Small molecule binding data for protein HIV-1 Protease
DOI: 10.7270/q22n50fh
title: BindingDB Entry 308: Cycloalkylpiperazines as HIV-1 Protease Inhibitors: Enhanced Oral Absorption

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q26d5r5v
title: BindingDB Entry 292: Small Molecule Inhibitors of Caspase-3

description: Small molecule binding data for protein Caspase-1 and Caspase-3, Uniprot P29466 and P42574
DOI: 10.7270/q2b56gw5
title: BindingDB Entry 290: Small Molecule Inhibitors of Caspase-3

description: Small molecule binding data for protein Caspase-1, Caspase-2, Caspase-3, Caspase-4, Caspase-5, Caspase-6, Caspase-7, and Caspase-8, Uniprot P29466, P42574, P42575, P49662, P51878, P55210, P55212, and Q14790
DOI: 10.7270/q2jm27t6
title: BindingDB Entry 312: Synthesis and Comparative Molecular Field Analysis (CoMFA) of Symmetric and Nonsymmetric Cyclic Sulfamide HIV-1 Protease Inhibitors

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2pc30jx
title: BindingDB Entry 311: SYNTHESIS AND PHARMACOKINETICS OF POTENT CARBAMATE HIV-1 PROTEASE INHIBITORS CONTAINING NOVEL HIGH AFFINITY HYDROXYETHYLAMINE ISOSTERES.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2t43r7t
title: BindingDB Entry 310: SYNTHESIS AND PHARMACOKINETICS OF POTENT CARBAMATE HIV-1 PROTEASE INHIBITORS CONTAINING NOVEL HIGH AFFINITY HYDROXYETHYLAMINE ISOSTERES.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2xw4gzt
title: BindingDB Entry 309: Cycloalkylpiperazines as HIV-1 Protease Inhibitors: Enhanced Oral Absorption

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q21n7z9r
title: BindingDB Entry 316: 5,6-Dihydropyran-2-ones Possessing Various Sulfonyl Functionalities: Potent Nonpeptidic Inhibitors of HIV Protease

description: Small molecule binding data for protein HIV-1 Protease
DOI: 10.7270/q25d8q1g
title: BindingDB Entry 315: 3-Tetrahydrofuran and Pyran Urethanes as High-Affinity P2-Ligands for HIV-1 Protease Inhibitors.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2862dnd
title: BindingDB Entry 327: Synthesis of Novel, Potent, Diol-Based HIV-1 Protease Inhibitors via Intermolecular Pinacol Homocoupling of (2S)-2-Benzyloxymethyl-4-phenylbutanal

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2959frs
title: BindingDB Entry 314: Cyclic Sulfolanes as Novel and High Affinity P2 Ligands for HIV-1 Protease Inhibitors

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2cz35ct
title: BindingDB Entry 324: Nonpeptidal P2 Ligands for HIV Protease Inhibitors: Structure-Based Design, Synthesis, and Biological Evaluation

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2dz06gr
title: BindingDB Entry 313: Design and Synthesis of Potent C2-Symmetric Diol-Based HIV-1 Protease Inhibitors: Effects of Fluoro Substitution

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2hq3x35
title: BindingDB Entry 323: Structure-Based Design of HIV Protease Inhibitors: Sulfonamide-Containing 5,6-Dihydro-4-hydroxy-2-pyrones as Non-Peptidic Inhibitors

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2ng4ns1
title: BindingDB Entry 322: The Development of Cyclic Sulfolanes as Novel and High-Affinity Pz Ligands for HIV-1 Protease Inhibitors

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2s46q4w
title: BindingDB Entry 320: Discovery of Novel, Non-Peptide HIV-1 Protease Inhibitors by Pharmacophore search

description: Small molecule binding data for protein HIV-1 Protease
DOI: 10.7270/q2ww7ftf
title: BindingDB Entry 319: Discovery of a Novel Class of Potent HIV-1 Protease Inhibitors Containing the (R)-( Hydroxyet hy1)urea Isostere.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q20p0x6c
title: BindingDB Entry 330: Synthesis and Structure-Activity Relationships of a Series of Penicillin-Derived HIV Proteinase Inhibitors Containing a Stereochemically Unique Peptide Isostere

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q24f1nxp
title: BindingDB Entry 328: A Series of Penicillin Derived C2-Symmetric Inhibitors of HIV-1 Proteinase: Synthesis, Mode of Interaction, and Structure-Activity Relationships

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2765ch1
title: BindingDB Entry 336: L-687,908, a potent hydroxyethylene-containing HIV protease inhibitor.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2bz647f
title: BindingDB Entry 335: 2 ,6 -Dimethylphenoxyacetyl: A New Achiral High Affinity P3-P2 Ligand for Peptidomimetic-Based HIV Protease Inhibitors

description: Small molecule binding data for protein HIV-1 Protease and HIV-2 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2gq6vzc
title: BindingDB Entry 334: Design, Synthesis, and Biological Evaluation of Monopyrrolinone-Based HIV-1 Protease Inhibitors.

description: Small molecule binding data for protein HIV-1 Protease
DOI: 10.7270/q2mg7mp3
title: BindingDB Entry 333: Structure-Activity Relationship of Small-Sized HIV Protease Inhibitors Containing Allophenylnorastatine.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2r78ccc
title: BindingDB Entry 332: Synthesis of Potent C2-Symmetric, Diol-Based HIV-1 Protease Inhibitors. Investigation of Thioalkyl and Thioaryl P1/P1  Substituents

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2vx0dq2
title: BindingDB Entry 331: Aminodiol HIV Protease Inhibitors. Synthesis And Structure-Activity Relationships Of P1/P1  Compounds: Correlation between Lipophilicity and Cytotoxicity

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q22f7kmg
title: BindingDB Entry 348: Potent, Orally Bioavailable HIV-1 Protease inhibitors Containing noncoded D-Amino Acids

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q23f4ms9
title: BindingDB Entry 337: L-735,524: an orally bioavailable human immunodeficiency virus type 1 protease inhibitor

description: Small molecule binding data for protein HIV-1 Protease, HIV-1 Protease Mutant (I47L), HIV-1 Protease Mutant (I50L), HIV-1 Protease Mutant (I84V), HIV-1 Protease Mutant (L23I), HIV-1 Protease Mutant (L23V), HIV-1 Protease Mutant (L76M), HIV-1 Protease Mutant (V32I), HIV-1 Protease Mutant (V82I), and HIV-2 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2668bb6
title: BindingDB Entry 345: A major role for a set of non-active site mutations in the development of HIV-1
protease drug resistance.

description: Small molecule binding data for protein HIV-1 Protease, HIV-1 Protease Mutant, A-1, HIV-1 Protease Mutant, ANAM-11, and HIV-1 Protease Mutant, NAM-10
DOI: 10.7270/q29z932m
title: BindingDB Entry 344: Hydroxyethylamine Isostere of an HIV-1 Protease Inhibitor Prefers Its Amine

description: Small molecule binding data for protein HIV-1 Protease and HIV-1 Protease Mutant (A71V/V82T/I84V)
DOI: 10.7270/q2fq9tsj
title: BindingDB Entry 343: Beta-Strand Mimicking Macrocyclic Amino Acids: Templates for Protease

description: Small molecule binding data for protein HIV-1 Protease
DOI: 10.7270/q2kh0kht
title: BindingDB Entry 342: In Vitro Anti-Human Immunodeficiency Virus (HIV)

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2q81b80
title: BindingDB Entry 341: Use of Medium-Sized Cycloalkyl Rings To Enhance Secondary Binding

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2v122zv
title: BindingDB Entry 340: Secondary Mutations M36I and A71V in the Human Immunodeficiency Virus Type

description: Small molecule binding data for protein HIV-1 Protease, HIV-1 Protease Mutant (A71V), HIV-1 Protease Mutant (D30N), HIV-1 Protease Mutant (D30N/A71V), HIV-1 Protease Mutant (D30N/M36I), HIV-1 Protease Mutant (D30N/M36I/A71V), HIV-1 Protease Mutant (M36I), and HIV-1 Protease Mutant (M36I/A71V)
DOI: 10.7270/q2zp449d
title: BindingDB Entry 338: Structure-Based Design of Sulfonamide- Substituted  Non-Pept idic HIV Protease Inhibitors

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q21j97xv
title: BindingDB Entry 356: Inhibitors of HIV-1 proteinase containing 2-heterosubstituted 4-amino-3-hydroxy-5-phenylpentanoic acid: synthesis, enzyme inhibition, and antiviral activity.

description: Small molecule binding data for protein HIV-1 Protease and HIV-2 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q257196c
title: BindingDB Entry 355: Aminodiol HIV Protease Inhibitors. 1. Design, Synthesis, and Preliminary SAR

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q29021xp
title: BindingDB Entry 354: Crystal-Structure-Based Design and Synthesis of Novel C-Terminal Inhibitors of HIV Protease.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2dr2snq
title: BindingDB Entry 353: Desigp and Synthesis of Peptidomimetic Inhibitors of HIV-1 Protease and Renin. Evidence for Improved Transport.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2jh3jcf
title: BindingDB Entry 352: Synthesis and Antiviral Activity of a Series of HIV-1 Protease Inhibitors with Functionality Tethered to the PI or PI  Phenyl Substituents: X-ray Crystal Structure Assisted Design

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2p84935
title: BindingDB Entry 351: Paracyclophanes: A Novel Class of Water-Soluble Inhibitors of HIV Proteinase.

description: Small molecule binding data for protein HIV-1 Protease and HIV-2 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2t151vx
title: BindingDB Entry 350: Design and Fast Synthesis of C-Terminal Duplicated Potent C2-Symmetric P1/P1  Modified HIV-1 Protease Inhibitors

description: Small molecule binding data for protein HIV-1 Protease
DOI: 10.7270/q2xs5skz
title: BindingDB Entry 349: Benzocycloalkyl Amines as Novel C-Termini for HIV Protease Inhibitors

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q20k26rk
title: BindingDB Entry 367: Structure-based design of novel HIV protease inhibitors: sulfonamide-containing 4-hydroxycoumarins and 4-hydroxy-2-pyrones as potent non-peptidic inhibitors.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q24b2zgx
title: BindingDB Entry 366: Cyclic HIV-1 protease inhibitors derived from mannitol: synthesis, inhibitory potencies, and computational predictions of binding affinities.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q28050s9
title: BindingDB Entry 363: Stereospecific synthesis, structure-activity relationship, and oral bioavailability of tetrahydropyrimidin-2-one HIV protease inhibitors.

description: Small molecule binding data for protein HIV-1 Protease
DOI: 10.7270/q2cr5rhb
title: BindingDB Entry 362: Design, synthesis, and evaluation of tetrahydropyrimidinones as an example of a general approach to nonpeptide HIV protease inhibitors.

description: Small molecule binding data for protein HIV-1 Protease
DOI: 10.7270/q2hh6h72
title: BindingDB Entry 361: Synthesis and evaluation of 2-pyridinone derivatives as HIV-1 specific reverse transcriptase inhibitors. 1. Phthalimidoalkyl and -alkylamino analogues.

description: Small molecule binding data for protein HIV-1 Reverse Transcriptase
DOI: 10.7270/q2n877zc
title: BindingDB Entry 360: HIV-1 Protease Inhibitors Based on Hydroxyethylene Dipeptide Isosteres: An Investigation into the Role of the P1  Side Chain on Structure-Activity.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2s180p3
title: BindingDB Entry 359: Tipranavir (PNU-140690): a potent, orally bioavailable nonpeptidic HIV protease inhibitor of the 5,6-dihydro-4-hydroxy-2-pyrone sulfonamide class.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2ws8rfk
title: BindingDB Entry 358: A novel nonpeptide HIV-1 protease inhibitor: elucidation of the binding mode and its application in the design of related analogs.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q23b5xbj
title: BindingDB Entry 382: Novel non-nucleoside inhibitors of human immunodeficiency virus type 1 (HIV-1) reverse transcriptase. 4. 2-Substituted dipyridodiazepinones as potent inhibitors of both wild-type and cysteine-181 HIV-1 reverse transcriptase enzymes.

description: Small molecule binding data for protein HIV-1 Reverse Transcriptase and HIV-1 Reverse Transcriptase Mutant (Y181C)
DOI: 10.7270/q2736p28
title: BindingDB Entry 378: Structure-based design of nonpeptidic HIV protease inhibitors: the sulfonamide-substituted cyclooctylpyramones.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2br8qcz
title: BindingDB Entry 375: Selective non-nucleoside HIV-1 reverse transcriptase inhibitors. New 2,3-dihydrothiazolo[2,3-a]isoindol-5(9bH)-ones and related compounds with anti-HIV-1 activity.

description: Small molecule binding data for protein HIV-1 Reverse Transcriptase
DOI: 10.7270/q2gh9g3p
title: BindingDB Entry 372: Synthesis and evaluation of 2-pyridinone derivatives as HIV-1-specific reverse transcriptase inhibitors. 2. Analogues of 3-aminopyridin-2(1H)-one.

description: Small molecule binding data for protein HIV-1 Reverse Transcriptase
DOI: 10.7270/q2m906tj
title: BindingDB Entry 371: Design and synthesis of HIV protease inhibitors. Variations of the carboxy terminus of the HIV protease inhibitor L-682,679.

description: Small molecule binding data for protein HIV-1 Protease
DOI: 10.7270/q2r20zjw
title: BindingDB Entry 370: Potent HIV protease inhibitors containing a novel (hydroxyethyl)amide isostere.

description: Small molecule binding data for protein HIV-1 Protease and HIV-2 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2vt1q89
title: BindingDB Entry 368: Inhibitors of human immunodeficiency virus type 1 protease containing 2-aminobenzyl-substituted 4-amino-3-hydroxy-5-phenylpentanoic acid: synthesis, activity, and oral bioavailability.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q22b8w65
title: BindingDB Entry 401: Structure-based design of novel HIV protease inhibitors: carboxamide-containing 4-hydroxycoumarins and 4-hydroxy-2-pyrones as potent nonpeptidic inhibitors.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7
DOI: 10.7270/q2639mxg
title: BindingDB Entry 399: Phenethylthiazolethiourea (PETT) compounds, a new class of HIV-1 reverse transcriptase inhibitors. 1. Synthesis and basic structure-activity relationship studies of PETT analogs.

description: Small molecule binding data for protein HIV-1 Reverse Transcriptase
DOI: 10.7270/q29w0cnf
title: BindingDB Entry 397: 4-hydroxy-5,6-dihydropyrones. 2. Potent non-peptide inhibitors of HIV protease.

description: Small molecule binding data for protein HIV-1 Protease, Uniprot Q8AFU8 C6G7Q7 A3FHG7