cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2jh3r8k
title: BindingDB Entry 50017543: Design, synthesis and biological evaluation of 1,5-disubstituted α-amino tetrazole derivatives as non-covalent inflammasome-caspase-1 complex inhibitors with potential application against immune and inflammatory disorders.

description: Small molecule binding data for protein Caspase-1, Uniprot P29466
DOI: 10.7270/q2p84gzf
title: BindingDB Entry 50017542: High-Throughput Screening Platform in Postnatal Heart Cells and Chemical Probe Toolbox to Assess Cardiomyocyte Proliferation.

description: Small molecule binding data for protein Casein kinase I isoform alpha, Casein kinase I isoform alpha-like, Casein kinase I isoform delta, Casein kinase I isoform epsilon, Mitogen-activated protein kinase 11, Mitogen-activated protein kinase 14, and RAF proto-oncogene serine/threonine-protein kinase, Uniprot P04049, P48729, P48730, P49674, Q15759, Q16539, and Q8N752
DOI: 10.7270/q2sx6j90
title: BindingDB Entry 50017541: Identification of indole-based activators of insulin degrading enzyme.

description: Small molecule binding data for protein Insulin-degrading enzyme, Uniprot P14735
DOI: 10.7270/q2xp7908
title: BindingDB Entry 50017537: Design, synthesis and biological evaluation of 7-((7H-pyrrolo[2,3-d]pyrimidin-4-yl)oxy)-2,3-dihydro-1H-inden-1-one derivatives as potent FAK inhibitors for the treatment of ovarian cancer.

description: Small molecule binding data for protein Focal adhesion kinase 1, Uniprot Q05397
DOI: 10.7270/q22f7sg5
title: BindingDB Entry 50017535: The discovery of 1, 3-diamino-7H-pyrrol[3, 2-f]quinazoline compounds as potent antimicrobial antifolates.

description: Small molecule binding data for protein Thymidylate synthase, Uniprot P0A884
DOI: 10.7270/q2668j7b
title: BindingDB Entry 50017533: Design, synthesis, and characterization of novel aminoalcohol quinolines with strong in vitro antimalarial activity.

description: Small molecule binding data for protein Cytochrome P450 3A4 and Potassium voltage-gated channel subfamily H member 2, Uniprot P08684 and Q12809
DOI: 10.7270/q29z98zb
title: BindingDB Entry 50017531: Antitumor activity of novel POLA1-HDAC11 dual inhibitors.

description: Small molecule binding data for protein Histone deacetylase 11, Uniprot Q96DB2
DOI: 10.7270/q2fr01pm
title: BindingDB Entry 50017529: Potent Anti-SARS-CoV-2 Activity by the Natural Product Gallinamide A and Analogues via Inhibition of Cathepsin L.

description: Small molecule binding data for protein Cathepsin B, Cathepsin K, Cathepsin L2, Cathepsin S, and Procathepsin L, Uniprot O60911, P06797, P07711, P07858, P25774, and P43235
DOI: 10.7270/q2kh0sch
title: BindingDB Entry 50017527: Design, Synthesis, and Structure-Activity Relationship Optimization of Pyrazolopyrimidine Amide Inhibitors of Phosphoinositide 3-Kinase γ (PI3Kγ).

description: Small molecule binding data for protein Cytochrome P450 1A2, Cytochrome P450 2B6, Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, and Potassium voltage-gated channel subfamily H member 2, Uniprot O00329, P05177, P08684, P10632, P10635, P11712, P20813, P33261, P42336, P42338, P48736, and Q12809
DOI: 10.7270/q2q52tqz
title: BindingDB Entry 50017526: Design of a "Two-in-One" Mutant-Selective Epidermal Growth Factor Receptor Inhibitor That Spans the Orthosteric and Allosteric Sites.

description: Small molecule binding data for protein Epidermal growth factor receptor, Uniprot P00533
DOI: 10.7270/q2tx3kfc
title: BindingDB Entry 50017525: Development of [

description: Small molecule binding data for protein Receptor-type tyrosine-protein kinase FLT3 [K633Q], Tyrosine-protein kinase Mer, Tyrosine-protein kinase receptor TYRO3, and Tyrosine-protein kinase receptor UFO, Uniprot P30530, P36888, Q06418, Q12866, and Q60805
DOI: 10.7270/q2zp4b53
title: BindingDB Entry 50017523: Molecular Plasticity of Crystalline CK2α' Leads to KN2, a Bivalent Inhibitor of Protein Kinase CK2 with Extraordinary Selectivity.

description: Small molecule binding data for protein Casein kinase I isoform epsilon and Casein kinase II subunit alpha, Uniprot P49674 and P68400
DOI: 10.7270/q23f4tqw
title: BindingDB Entry 50017522: Discovery of STAT3 and Histone Deacetylase (HDAC) Dual-Pathway Inhibitors for the Treatment of Solid Cancer.

description: Small molecule binding data for protein Histone deacetylase, Histone deacetylase 1, Histone deacetylase 6, and Signal transducer and activator of transcription 3, Uniprot O15379, P40763, P56524, Q13547, Q8WUI4, Q92769, Q969S8, Q96DB2, Q9BY41, Q9UBN7, Q9UKV0, and Q9UQL6
DOI: 10.7270/q2765kd5
title: BindingDB Entry 50017516: Expedited Approach toward the Rational Design of Noncovalent SARS-CoV-2 Main Protease Inhibitors.

description: Small molecule binding data for protein Calpain-1 catalytic subunit, Procathepsin L, Replicase polyprotein 1ab, and Trypsin, Uniprot P07384, P07477, P07478, P07711, P0DTD1, and P35030
DOI: 10.7270/q2bz6b4k
title: BindingDB Entry 50017511: Identification of TUL01101: A Novel Potent and Selective JAK1 Inhibitor for the Treatment of Rheumatoid Arthritis.

description: Small molecule binding data for protein Cytochrome P450 1A2, Cytochrome P450 2B6, Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, Non-receptor tyrosine-protein kinase TYK2/Tyrosine-protein kinase JAK1/Tyrosine-protein kinase JAK2, Tyrosine-protein kinase JAK1, Tyrosine-protein kinase JAK2, and Tyrosine-protein kinase JAK3, Uniprot O60674, P05177, P08684, P10632, P10635, P11712, P20813, P23458, P29597, P33261, and P52333
DOI: 10.7270/q2gq72tf
title: BindingDB Entry 50017509: Discovery of Novel Orally Bioavailable Triazoles with Potent and Broad-Spectrum Antifungal Activity In Vitro and In Vivo.

description: Small molecule binding data for protein Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, and Potassium voltage-gated channel subfamily H member 2, Uniprot P05177, P08684, P10635, P11712, P33261, and Q12809
DOI: 10.7270/q2mc943d
title: BindingDB Entry 50017508: Optimization of Benzamide Derivatives as Potent and Orally Active Tubulin Inhibitors Targeting the Colchicine Binding Site.

description: Small molecule binding data for protein Potassium voltage-gated channel subfamily H member 2, Sodium channel protein type 5 subunit alpha, and Voltage-dependent L-type calcium channel subunit beta-2, Uniprot Q08289, Q12809, and Q14524
DOI: 10.7270/q2r49vtb
title: BindingDB Entry 50017507: Structure-Based Design of a Dual-Targeted Covalent Inhibitor Against Papain-like and Main Proteases of SARS-CoV-2.

description: Small molecule binding data for protein Cathepsin B, Procathepsin L, and Replicase polyprotein 1ab, Uniprot P07711, P07858, and P0DTD1
DOI: 10.7270/q2vx0mkr
title: BindingDB Entry 50017506: Discovery and Crystallographic Studies of Nonpeptidic Piperazine Derivatives as Covalent SARS-CoV-2 Main Protease Inhibitors.

description: Small molecule binding data for protein Caspase-3, Cathepsin B, Cathepsin F, Cathepsin K, Procathepsin L, and Replicase polyprotein 1ab, Uniprot P07711, P07858, P0DTD1, P42574, P43235, and Q9UBX1
DOI: 10.7270/q20p143w
title: BindingDB Entry 50017505: BAY-7081: A Potent, Selective, and Orally Bioavailable Cyanopyridone-Based PDE9A Inhibitor.

description: Small molecule binding data for protein Cytochrome P450 2C9 and High affinity cGMP-specific 3',5'-cyclic phosphodiesterase 9A, Uniprot O70628, O76083, and P11712
DOI: 10.7270/q24f1vtt
title: BindingDB Entry 50017504: Tricyclic SpiroLactams Kill Mycobacteria In Vitro and In Vivo by Inhibiting Type II NADH Dehydrogenases.

description: Small molecule binding data for protein Type II NADH:quinone oxidoreductase Ndh and Type II NADH:quinone oxidoreductase NdhA, Uniprot P95160 and P95200
DOI: 10.7270/q2862mjj
title: BindingDB Entry 50017503: Solid-Phase Synthesis of Cereblon-Recruiting Selective Histone Deacetylase 6 Degraders (HDAC6 PROTACs) with Antileukemic Activity.

description: Small molecule binding data for protein Histone deacetylase 1 and Histone deacetylase 6, Uniprot Q13547 and Q9UBN7
DOI: 10.7270/q2cz3c7h
title: BindingDB Entry 50017502: Structure-Based Design of Tropane Derivatives as a Novel Series of CCR5 Antagonists with Broad-Spectrum Anti-HIV-1 Activities and Improved Oral Bioavailability.

description: Small molecule binding data for protein C-C chemokine receptor type 5, Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, and Cytochrome P450 3A4, Uniprot P05177, P08684, P10635, P11712, P33261, and P51681
DOI: 10.7270/q2hm5dh2
title: BindingDB Entry 50017497: The Highly Potent AhR Agonist Picoberin Modulates Hh-Dependent Osteoblast Differentiation.

description: Small molecule binding data for protein Aryl hydrocarbon receptor, Uniprot P30561 and P35869
DOI: 10.7270/q2nc657s
title: BindingDB Entry 50017495: Design, synthesis, and bioevaluation of imidazo [1,2-a] pyrazine derivatives as tubulin polymerization inhibitors with potent anticancer activities.

description: Small molecule binding data for protein Tubulin beta chain, Uniprot P02554
DOI: 10.7270/q2s46x11
title: BindingDB Entry 50017491: Discovery of GDC-0077 (Inavolisib), a Highly Selective Inhibitor and Degrader of Mutant PI3Kα.

description: Small molecule binding data for protein Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, and Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, Uniprot O00329, P05177, P08684, P10632, P10635, P11712, P33261, P42336, P42338, and P48736
DOI: 10.7270/q2ww7nr1
title: BindingDB Entry 50017489: Discovery of Orally Bioavailable

description: Small molecule binding data for protein Ubiquitin carboxyl-terminal hydrolase 7, Uniprot Q93009
DOI: 10.7270/q21n8568
title: BindingDB Entry 50017488: Computational design, synthesis and biological evaluation of PDE5 inhibitors based on N

description: Small molecule binding data for protein cGMP-specific 3',5'-cyclic phosphodiesterase, Uniprot O76074
DOI: 10.7270/q25d8wx6
title: BindingDB Entry 50017487: Design and Synthesis of Fibroblast Growth Factor Receptor (FGFR) and Histone Deacetylase (HDAC) Dual Inhibitors for the Treatment of Cancer.

description: Small molecule binding data for protein Fibroblast growth factor receptor 1, Fibroblast growth factor receptor 2, Fibroblast growth factor receptor 3, Fibroblast growth factor receptor 4, Histone deacetylase 1, Histone deacetylase 2, Histone deacetylase 6, and Histone deacetylase 8, Uniprot P11362, P21802, P22455, P22607, Q13547, Q92769, Q9BY41, and Q9UBN7
DOI: 10.7270/q2959nmg
title: BindingDB Entry 50017485: Development of Alkylated Hydrazides as Highly Potent and Selective Class I Histone Deacetylase Inhibitors with T cell Modulatory Properties.

description: Small molecule binding data for protein Histone deacetylase 1, Histone deacetylase 11, Histone deacetylase 2, Histone deacetylase 3, Histone deacetylase 4, Histone deacetylase 6, and Histone deacetylase 8, Uniprot O15379, P56524, Q13547, Q92769, Q96DB2, Q9BY41, and Q9UBN7
DOI: 10.7270/q2dv1pz5
title: BindingDB Entry 50017484: Making Protein Degradation Visible: Discovery of Theranostic PROTACs for Detecting and Degrading NAMPT.

description: Small molecule binding data for protein Nicotinamide phosphoribosyltransferase, Uniprot P43490
DOI: 10.7270/q2jm2fpw
title: BindingDB Entry 50017482: B-cell Lymphoma 6 Inhibitors: Current Advances and Prospects of Drug Development for Diffuse Large B-cell Lymphomas.

description: Small molecule binding data for protein B-cell lymphoma 6 protein, Uniprot P41182
DOI: 10.7270/q2pc36f2
title: BindingDB Entry 50017481: Pyrazole-containing pharmaceuticals: target, pharmacological activity, and their SAR studies.

description: Small molecule binding data for protein ALK tyrosine kinase receptor, Androgen receptor, Cannabinoid receptor 1, Dipeptidyl peptidase 4, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, Plasma kallikrein, Rho-associated protein kinase 2, Type-1 angiotensin II receptor, Tyrosine-protein kinase BTK, Tyrosine-protein kinase JAK1, Tyrosine-protein kinase JAK2, and cGMP-specific 3',5'-cyclic phosphodiesterase, Uniprot O00329, O60674, O75116, O76074, P03952, P10275, P21554, P23458, P27487, P34976, Q06187, and Q9UM73
DOI: 10.7270/q2t43z5d
title: BindingDB Entry 50017480: Identification and Characterization of a Novel Indoleamine 2,3-Dioxygenase 1 Protein Degrader for Glioblastoma.

description: Small molecule binding data for protein Indoleamine 2,3-dioxygenase 1, Uniprot P14902
DOI: 10.7270/q2xw4pwd
title: BindingDB Entry 50017479: The discovery of (1R, 3R)-1-(3-chloro-5-fluorophenyl)-3-(hydroxymethyl)-1,2,3,4-tetrahydroisoquinoline-6-carbonitrile, a potent and selective agonist of human transient receptor potential cation channel subfamily m member 5 (TRPM5) and evaluation of as a potential gastrointestinal prokinetic agent.

description: Small molecule binding data for protein Transient receptor potential cation channel subfamily A member 1, Transient receptor potential cation channel subfamily M member 4, Transient receptor potential cation channel subfamily M member 5, Transient receptor potential cation channel subfamily M member 8, Transient receptor potential cation channel subfamily V member 1, and Transient receptor potential cation channel subfamily V member 4, Uniprot O75762, Q7Z2W7, Q8NER1, Q8TD43, Q9HBA0, Q9JJH7, and Q9NZQ8
DOI: 10.7270/q22n56c3
title: BindingDB Entry 50017478: Novel bioactive hybrid Celecoxib-HDAC Inhibitor, induces apoptosis in human acute lymphoblastic leukemia cells.

description: Small molecule binding data for protein Histone deacetylase, Uniprot O15379, P56524, Q13547, Q8WUI4, Q92769, Q969S8, Q96DB2, Q9BY41, Q9UBN7, Q9UKV0, and Q9UQL6
DOI: 10.7270/q26d5z20
title: BindingDB Entry 50017477: Discovery of a Series of 5-Amide-1

description: Small molecule binding data for protein P2Y purinoceptor 1, P2Y purinoceptor 11, P2Y purinoceptor 12, P2Y purinoceptor 13, P2Y purinoceptor 14, P2Y purinoceptor 2, P2Y purinoceptor 4, and P2Y purinoceptor 6, Uniprot P41231, P47900, P51582, Q15077, Q15391, Q96G91, Q9BPV8, and Q9H244
DOI: 10.7270/q2b280cc
title: BindingDB Entry 50017475: Macrocyclization of Quinazoline-Based EGFR Inhibitors Leads to Exclusive Mutant Selectivity for EGFR L858R and Del19.

description: Small molecule binding data for protein Epidermal growth factor receptor, Uniprot P00533
DOI: 10.7270/q2ft8r3d
title: BindingDB Entry 50017473: Discovery of novel N-(1-benzyl-1H-imidazol-2-yl)amide derivatives as melanocortin 1 receptor agonists.

description: Small molecule binding data for protein Melanocyte-stimulating hormone receptor, Uniprot Q01726
DOI: 10.7270/q2kk9gwm
title: BindingDB Entry 50017471: Design, synthesis, and biological studies of dual URAT1 inhibitor and FXR agonist based on benzbromarone.

description: Small molecule binding data for protein Bile acid receptor, Uniprot Q96RI1
DOI: 10.7270/q2qc07mw
title: BindingDB Entry 50017469: Small-Molecule Receptor-Interacting Protein 1 (RIP1) Inhibitors as Therapeutic Agents for Multifaceted Diseases: Current Medicinal Chemistry Insights and Emerging Opportunities.

description: Small molecule binding data for protein Mixed lineage kinase domain-like protein, RalA-binding protein 1, Receptor-interacting serine/threonine-protein kinase 1, and Receptor-interacting serine/threonine-protein kinase 3, Uniprot Q13546, Q60855, Q62172, Q8NB16, and Q9Y572
DOI: 10.7270/q2v41095
title: BindingDB Entry 50017467: Synthesis and in vitro biological evaluation of 3-ethyl-1,5-naphthyridin-2(1H)-one derivatives as potent PARP-1 selective inhibitors and PARP-1 DNA trappers.

description: Small molecule binding data for protein Poly [ADP-ribose] polymerase 1 and Poly [ADP-ribose] polymerase 2, Uniprot P09874 and Q9UGN5
DOI: 10.7270/q2zw1r16
title: BindingDB Entry 50017464: Photoredox-based late-stage functionalization in SAR study for in vivo potent glucosylceramide synthase inhibitor.

description: Small molecule binding data for protein Ceramide glucosyltransferase, Uniprot O88693 and Q16739
DOI: 10.7270/q23n27g1
title: BindingDB Entry 50017461: Synthesis, evaluation and mechanism exploration of 2-(N-(3-nitrophenyl)-N-phenylsulfonyl)aminoacetohydroxamic acids as novel urease inhibitors.

description: Small molecule binding data for protein Urease subunit beta, Uniprot P69996
DOI: 10.7270/q27948rk
title: BindingDB Entry 50017457: Targeting osteoarthritis-associated galectins and an induced effector class by a ditopic bifunctional reagent: Impact of its glycan part on binding measured in the tissue context.

description: Small molecule binding data for protein Collagenase 3, Uniprot P45452
DOI: 10.7270/q2c251g9
title: BindingDB Entry 50017455: Enhancing the Safety and Efficacy of PSMA-Based Small-Molecule Drug Conjugates by Linker Stabilization and Conjugation to Transthyretin Binding Ligand.

description: Small molecule binding data for protein Transthyretin, Uniprot P02766
DOI: 10.7270/q2gt5s7s
title: BindingDB Entry 50017453: Conformationally Defined Rexinoids for the Prevention of Inflammation and Nonmelanoma Skin Cancers.

description: Small molecule binding data for protein Retinoic acid receptor RXR-alpha, Uniprot P19793
DOI: 10.7270/q2mk6hz3
title: BindingDB Entry 50017452: Discovery of JNJ-64264681: A Potent and Selective Covalent Inhibitor of Bruton's Tyrosine Kinase.

description: Small molecule binding data for protein Cytoplasmic tyrosine-protein kinase BMX, Tyrosine-protein kinase BTK, Tyrosine-protein kinase Blk, and Tyrosine-protein kinase Tec, Uniprot P42680, P51451, P51813, and Q06187
DOI: 10.7270/q2rb78pt
title: BindingDB Entry 50017450: The inhibition of monoamine oxidase by 2H-1,4-benzothiazin-3(4H)-ones.

description: Small molecule binding data for protein Amine oxidase [flavin-containing] A, Amine oxidase [flavin-containing] B, and D-amino-acid oxidase, Uniprot P00371, P21397, and P27338
DOI: 10.7270/q2w381dj
title: BindingDB Entry 50017449: Selective butyrylcholinesterase inhibition by isatin dimers and 3-indolyl-3-hydroxy-2-oxindole dimers.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot O42275 and P81908
DOI: 10.7270/q20v8hvp
title: BindingDB Entry 50017448: Exploratory study of oxatomide derivatives with high P2X

description: Small molecule binding data for protein P2X purinoceptor 7, Uniprot Q99572
DOI: 10.7270/q24j0k63
title: BindingDB Entry 50017445: The Pursuit of Enzyme Activation: A Snapshot of the Gold Rush.

description: Small molecule binding data for protein NAD-dependent protein deacylase sirtuin-6 and Serine/threonine-protein kinase ULK1, Uniprot O75385 and Q8N6T7
DOI: 10.7270/q28919xd
title: BindingDB Entry 50017444: Small Molecule Inhibitors of Lymphocyte Perforin as Focused Immunosuppressants for Infection and Autoimmunity.

description: Small molecule binding data for protein Acetylcholinesterase and Perforin-1, Uniprot P10820, P14222, and P22303
DOI: 10.7270/q2d222q1
title: BindingDB Entry 50017441: Inhibition of glutathione S-transferases by photoactive calix[4]arene α-ketophosphonic acids.

description: Small molecule binding data for protein Glutathione S-transferase A1 and Glutathione S-transferase P, Uniprot P08263 and P09211
DOI: 10.7270/q2ht2tf2
title: BindingDB Entry 50017440: Targeting Extracellular Signal-Regulated Protein Kinase 1/2 (ERK1/2) in Cancer: An Update on Pharmacological Small-Molecule Inhibitors.

description: Small molecule binding data for protein Mitogen-activated protein kinase 1 and Mitogen-activated protein kinase 3, Uniprot P27361, P28482, and P63086
DOI: 10.7270/q2nk3k4b
title: BindingDB Entry 50017439: Subtilisin-like Serine Protease 1 (SUB1) as an Emerging Antimalarial Drug Target: Current Achievements in Inhibitor Discovery.

description: Small molecule binding data for protein Subtilisin-like protease 1, Uniprot Q7KAN4
DOI: 10.7270/q2sb49t6
title: BindingDB Entry 50017436: Mechanism of Action and Structure-Activity Relationship of α-Conotoxin Mr1.1 at the Human α9α10 Nicotinic Acetylcholine Receptor.

description: Small molecule binding data for protein Neuronal acetylcholine receptor subunit alpha-3/beta-2, Neuronal acetylcholine receptor subunit alpha-7, and Neuronal acetylcholine receptor; alpha9/alpha10, Uniprot P17787, P32297, P36544, Q9GZZ6, and Q9UGM1
DOI: 10.7270/q2x352hg
title: BindingDB Entry 50017434: Inhibiting Sodium Taurocholate Cotransporting Polypeptide in HBV-Related Diseases: From Biological Function to Therapeutic Potential.

description: Small molecule binding data for protein Sodium/bile acid cotransporter, Uniprot Q14973
DOI: 10.7270/q21r6vm6
title: BindingDB Entry 50017431: Modulating the selectivity of inhibitors for prolyl oligopeptidase inhibitors and fibroblast activation protein-α for different indications.

description: Small molecule binding data for protein Dipeptidyl peptidase 4 and Prolyl endopeptidase FAP, Uniprot P27487 and Q12884
DOI: 10.7270/q25h7mbx
title: BindingDB Entry 50017428: The Repertoire of Small-Molecule PET Probes for Neuroinflammation Imaging: Challenges and Opportunities beyond TSPO.

description: Small molecule binding data for protein Advanced glycosylation end product-specific receptor, Amine oxidase [flavin-containing] B, Bifunctional epoxide hydrolase 2, Cannabinoid receptor 1, Cannabinoid receptor 2, Glycogen synthase kinase-3, Glycogen synthase kinase-3 beta, Macrophage colony-stimulating factor 1 receptor, Melatonin receptor type 1A, Mu-type opioid receptor, P2X purinoceptor 7, P2Y purinoceptor 12, Prostaglandin G/H synthase 1, Prostaglandin G/H synthase 2, Sphingosine 1-phosphate receptor 1, Sphingosine 1-phosphate receptor 2, Tyrosine-protein kinase Mer, and cAMP-specific 3',5'-cyclic phosphodiesterase 4D, Uniprot O95136, P07333, P19643, P21453, P21554, P23219, P27338, P34913, P34972, P35354, P35372, P48039, P49840, P49841, Q08499, Q12866, Q15109, Q99572, and Q9H244
DOI: 10.7270/q2988c33
title: BindingDB Entry 50017427: Identification of C5-NH

description: Small molecule binding data for protein Cytochrome P450 1A2, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A4, Integrase, and Neuraminidase, Uniprot P03468, P05177, P08684, P10635, P11712, P33261, and Q7ZJM1
DOI: 10.7270/q2f193td
title: BindingDB Entry 50017424: Specific Inhibitor of Placental Alkaline Phosphatase Isolated from a DNA-Encoded Chemical Library Targets Tumor of the Female Reproductive Tract.

description: Small molecule binding data for protein Alkaline phosphatase, placental type and Alkaline phosphatase, tissue-nonspecific isozyme, Uniprot P05186 and P05187
DOI: 10.7270/q2js9vjf
title: BindingDB Entry 50017423: Fragment-Guided Discovery of Pyrazole Carboxylic Acid Inhibitors of the Kelch-like ECH-Associated Protein 1: Nuclear Factor Erythroid 2 Related Factor 2 (KEAP1:NRF2) Protein-Protein Interaction.

description: Small molecule binding data for protein Kelch-like ECH-associated protein 1 and Nuclear factor erythroid 2-related factor 2, Uniprot Q14145 and Q16236