cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q22j6drv
title: BindingDB Entry 50047158: Discovery of CREBBP Bromodomain Inhibitors by High-Throughput Docking and Hit Optimization Guided by Molecular Dynamics.

description: Small molecule binding data for protein CREB-binding protein/p53, Uniprot Q92793
DOI: 10.7270/q22z17gf
title: BindingDB Entry 50047670: Twenty Crystal Structures of Bromodomain and PHD Finger Containing Protein 1 (BRPF1)/Ligand Complexes Reveal Conserved Binding Motifs and Rare Interactions.

description: Small molecule binding data for protein Peregrin, Uniprot P55201
DOI: 10.7270/q26975f4
title: BindingDB Entry 50047157: Structure-Guided Design of IACS-9571, a Selective High-Affinity Dual TRIM24-BRPF1 Bromodomain Inhibitor.

description: Small molecule binding data for protein Bromodomain adjacent to zinc finger domain protein 2B, Bromodomain and PHD finger-containing protein 3, Bromodomain-containing protein 1, Bromodomain-containing protein 4, Peregrin, Transcription initiation factor TFIID subunit 1, and Transcription intermediary factor 1-alpha, Uniprot O15164, O60885, O95696, P21675, P55201, Q9UIF8, and Q9ULD4
DOI: 10.7270/q26q205q
title: BindingDB Entry 50047669: Synthesis, Structural Elucidation, and Biological Evaluation of NSC12, an Orally Available Fibroblast Growth Factor (FGF) Ligand Trap for the Treatment of FGF-Dependent Lung Tumors.

description: Small molecule binding data for protein Basic fibroblast growth factor, Uniprot P09038
DOI: 10.7270/q29z96s8
title: BindingDB Entry 50047156: Definitive Metabolite Identification Coupled with Automated Ligand Identification System (ALIS) Technology: A Novel Approach to Uncover Structure-Activity Relationships and Guide Drug Design in a Factor IXa Inhibitor Program.

description: Small molecule binding data for protein Coagulation factor IX and X and Coagulation factor X/antithrombin III, Uniprot P00740 and P00742
DOI: 10.7270/q2bc41gq
title: BindingDB Entry 50047668: 5'-Substituted Amiloride Derivatives as Allosteric Modulators Binding in the Sodium Ion Pocket of the Adenosine A2A Receptor.

description: Small molecule binding data for protein Adenosine A2 receptor and Adenosine receptor A2a, Uniprot P29274 and P29275
DOI: 10.7270/q2bp04sk
title: BindingDB Entry 50048203: Dithiocarbamates effectively inhibit theß-carbonic anhydrase from the dandruff-producing fungus Malassezia globosa.

description: Small molecule binding data for protein Carbonic anhydrase and Carbonic anhydrase 2, Uniprot P00915 and P00918
DOI: 10.7270/q2fq9zg5
title: BindingDB Entry 50047155: Design, synthesis, and analysis of antagonists of GPR55: Piperidine-substituted 1,3,4-oxadiazol-2-ones.

description: Small molecule binding data for protein G-protein coupled receptor 55, Uniprot Q9Y2T6
DOI: 10.7270/q2gf0whx
title: BindingDB Entry 50048202: A one-pot laccase-catalysed synthesis of coumestan derivatives and their anticancer activity.

description: Small molecule binding data for protein Arachidonate 5-lipoxygenase
DOI: 10.7270/q2kw5hzh
title: BindingDB Entry 50047666: Discovery of CNS Penetrant CXCR2 Antagonists for the Potential Treatment of CNS Demyelinating Disorders.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GLS2, Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and Interleukin-8 receptors, CXCR2, Uniprot P05177, P08684, P10635, P11712, P25025, P33261, and P40989
DOI: 10.7270/q2m61n7n
title: BindingDB Entry 50048201: 5-Substituted-benzylsulfanyl-thiophene-2-sulfonamides with effective carbonic anhydrase inhibitory activity: Solution and crystallographic investigations.

description: Small molecule binding data for protein Carbonic anhydrase, Carbonic anhydrase 2, and Carbonic anhydrase 9, Uniprot O43570, P00915, P00918, and Q16790
DOI: 10.7270/q2qv3phw
title: BindingDB Entry 50048200: Design, synthesis and biological evaluation of novel 4-(2-fluorophenoxy)quinoline derivatives as selective c-Met inhibitors.

description: Small molecule binding data for protein ALK tyrosine kinase receptor, Epidermal growth factor receptor, Hepatocyte growth factor receptor, Tyrosine-protein kinase Kit (Kit), Tyrosine-protein kinase receptor FLT3, and Vascular endothelial growth factor receptor 2, Uniprot P00533, P08581, P10721, P35968, P36888, and Q9UM73
DOI: 10.7270/q2t155h3
title: BindingDB Entry 50047160: Discovery of Selective Histone Deacetylase 6 Inhibitors Using the Quinazoline as the Cap for the Treatment of Cancer.

description: Small molecule binding data for protein Histone Deacetylase 10 (HDAC10), Histone deacetylase, Histone deacetylase 1, Histone deacetylase 1/3/5/8, Histone deacetylase 11, Histone deacetylase 3/NCoR1, Histone deacetylase 4, Histone deacetylase 7 (HDAC7), and Histone deacetylase 8, Uniprot A0A024QZ26, O15379, P56524, Q13547, Q8WUI4, Q92769, Q969S8, Q96DB2, Q9BY41, Q9UBN7, Q9UKV0, and Q9UQL6
DOI: 10.7270/q2vm4f7m
title: BindingDB Entry 50048199: Discovery of New Bromodomain Scaffolds by Biosensor Fragment Screening.

description: Small molecule binding data for protein Bromodomain-containing protein 4, CREB-binding protein/p53, and Histone acetyltransferase KAT2A/KAT2B, Uniprot O60885, Q92793, and Q92831
DOI: 10.7270/q2348ncr
title: BindingDB Entry 50048205: Hydrazone Linker as a Useful Tool for Preparing Chimeric Peptide/Nonpeptide Bifunctional Compounds.

description: Small molecule binding data for protein Neurokinin 1 receptor, Nociceptin/mu opioid receptor, and Opioid receptors; mu & delta, Uniprot P14600, P33533, and P33535
DOI: 10.7270/q26w9d2q
title: BindingDB Entry 50048204: Design, Synthesis, and Evaluation of Novel and Selective G-protein Coupled Receptor 120 (GPR120) Spirocyclic Agonists.

description: Small molecule binding data for protein Free fatty acid receptor 1, Free fatty acid receptor 4, and Omega-3 fatty acid receptor 1, Uniprot O14842, Q5NUL3, and Q7TMA4
DOI: 10.7270/q2930w23
title: BindingDB Entry 50047164: Discovery of Novel and Orally Bioavailable Inhibitors of PI3 Kinase Based on Indazole Substituted Morpholino-Triazines.

description: Small molecule binding data for protein Cytochrome P450 2C19, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and PI3-kinase subunit alpha, Uniprot P08684, P10635, P33261, and P42336
DOI: 10.7270/q2dv1mrn
title: BindingDB Entry 50047163: KATching-Up on Small Molecule Modulators of Lysine Acetyltransferases.

description: Small molecule binding data for protein Bromodomain-containing protein 4, CREB-binding protein/p53, Histone acetyltransferase KAT2A, Histone acetyltransferase KAT5, Histone acetyltransferase PCAF, Histone acetyltransferase p300, and Spermidine synthase, Uniprot O60885, Q09472, Q92793, Q92830, Q92831, and Q92993
DOI: 10.7270/q2jh3p22
title: BindingDB Entry 50047162: Identification of SNAIL1 Peptide-Based Irreversible Lysine-Specific Demethylase 1-Selective Inactivators.

description: Small molecule binding data for protein Amine oxidase [flavin-containing] A, Amine oxidase [flavin-containing] B, Histone demethylase JARID1A, Lysine-specific histone demethylase 1A, and Lysine-specific histone demethylase 1B, Uniprot O60341, P21397, P27338, P29375, and Q8NB78
DOI: 10.7270/q2k64m38
title: BindingDB Entry 50048209: Mycobacterium Tuberculosis (MTB) GyrB inhibitors: An attractive approach for developing novel drugs against TB.

description: Small molecule binding data for protein DNA Gyrase Subunit B and DNA gyrase subunit B, Uniprot P0AES6 and P0C559
DOI: 10.7270/q2p84drx
title: BindingDB Entry 50047161: Docking and Linking of Fragments To Discover Jumonji Histone Demethylase Inhibitors.

description: Small molecule binding data for protein Histone demethylase JARID1A, Hypoxia-inducible factor 1 (FIH), Lysine-specific demethylase 2A, Lysine-specific demethylase 3A, Lysine-specific demethylase 4C (KDM4C), Lysine-specific demethylase 4D, Lysine-specific demethylase 5B (KDM5Flag-5B-FL), and Lysine-specific demethylase 6B (KDM6B), Uniprot I3VM53, O15054, P29375, Q6B0I6, Q9H3R0, Q9NWT6, Q9UGL1, Q9Y2K7, and Q9Y4C1
DOI: 10.7270/q2pn97jv
title: BindingDB Entry 50047673: Design, Synthesis, and Evaluation of Donepezil-Like Compounds as AChE and BACE-1 Inhibitors.

description: Small molecule binding data for protein Acetylcholinesterase, Beta-secretase 1 (BACE1), and Butyrylcholinesterase (BuChE), Uniprot P22303, P56818, and P81908
DOI: 10.7270/q2tf0084
title: BindingDB Entry 50047672: An Unusual Natural Product Primary Sulfonamide: Synthesis, Carbonic Anhydrase Inhibition, and Protein X-ray Structures of Psammaplin C.

description: Small molecule binding data for protein Carbonic Anhydrase VA, Carbonic Anhydrase XIV, Carbonic anhydrase, Carbonic anhydrase 12, Carbonic anhydrase 13 (CA XIII), Carbonic anhydrase 2, Carbonic anhydrase 4, Carbonic anhydrase 6 (CA-VI), Carbonic anhydrase 7, and Carbonic anhydrase 9, Uniprot O43570, P00915, P00918, P22748, P23280, P35218, P43166, Q16790, Q8N1Q1, and Q9ULX7
DOI: 10.7270/q2tq63hj
title: BindingDB Entry 50048207: Quinolino[3,4-b]quinoxalines and pyridazino[4,3-c]quinoline derivatives: Synthesis, inhibition of topoisomerase IIa, G-quadruplex binding and cytotoxic properties.

description: Small molecule binding data for protein Topoisomerase II alpha (HuTopoIIα), Uniprot P11388
DOI: 10.7270/q2xs5x8k
title: BindingDB Entry 50047159: Tactical Approaches to Interconverting GPCR Agonists and Antagonists.

description: Small molecule binding data for protein Adenosine receptor A3, Angiotensin II receptor, BDKRB2, Histamine receptor (H3), Kappa-type opioid receptor, Melanocortin receptor 4, Melatonin receptor, Mu-type opioid receptor, Nociceptin receptor, Serotonin (5-HT) receptor, and Vasopressin V2 receptor (V2), Uniprot P0DMS8, P19327, P30411, P30518, P32245, P32305, P35372, P41145, P41146, P48039, P49286, P50052, and Q9Y5N1
DOI: 10.7270/q2z60r0g
title: BindingDB Entry 50047671: Exploitation of a Novel Binding Pocket in Human Lipoprotein-Associated Phospholipase A2 (Lp-PLA2) Discovered through X-ray Fragment Screening.

description: Small molecule binding data for protein LDL-associated phospholipase A2, Uniprot Q13093
DOI: 10.7270/q2zc84wf
title: BindingDB Entry 50048206: Discovery of a Potent, Selective, and Orally Available PI3Kd Inhibitor for the Treatment of Inflammatory Diseases.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform/gamma isoform, Phosphoinositide 3-Kinase (PI3K), delta, p110α/p85α, and p110β/p85α, Uniprot O00329, P05177, P08684, P10635, P11712, P27986, P33261, P42336, P42338, and P48736
DOI: 10.7270/q21j9cpc
title: BindingDB Entry 50047166: Synthesis and structure activity relationship investigation of triazolo[1,5-a]pyrimidines as CB2 cannabinoid receptor inverse agonists.

description: Small molecule binding data for protein Cannabinoid receptor 1 and Cannabinoid receptor 2, Uniprot P21554 and P34972
DOI: 10.7270/q21z46b2
title: BindingDB Entry 50047678: Benzamide capped peptidomimetics as non-ATP competitive inhibitors of CDK2 using the REPLACE strategy.

description: Small molecule binding data for protein Cyclin-Dependent Kinase 2 (CDK2) and Cyclin-Dependent Kinase 4 (CDK4), Uniprot P11802, P20248, P24385, and P24941
DOI: 10.7270/q2251m6g
title: BindingDB Entry 50048213: High-affinity small molecular blockers of mixed lineage leukemia 1 (MLL1)-WDR5 interaction inhibit MLL1 complex H3K4 methyltransferase activity.

description: Small molecule binding data for protein MLL and WD repeat-containing protein 5 (WDR5), Uniprot P61964, Q03164, Q15291, and Q9UBL3
DOI: 10.7270/q25b04dn
title: BindingDB Entry 50047165: Potent Triazole Bisphosphonate Inhibitor of Geranylgeranyl Diphosphate Synthase.

description: Small molecule binding data for protein Farnesyl diphosphate synthase and Geranylgeranyl Diphosphate Synthase (GGPPS), Uniprot O95749 and P14324
DOI: 10.7270/q25q4z1z
title: BindingDB Entry 50047677: N-Nitrosulfonamides: A new chemotype for carbonic anhydrase inhibition.

description: Small molecule binding data for protein Carbonic anhydrase 2 and Carbonic anhydrase 9, Uniprot P00918 and Q16790
DOI: 10.7270/q25x2bxg
title: BindingDB Entry 50048212: Neurodegenerative diseases linked to misfolded proteins and their therapeutic approaches: A review.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot P22303
DOI: 10.7270/q29g5pqt
title: BindingDB Entry 50047676: Synthesis and biological evaluation of new [1,2,4]triazolo[4,3-a]pyridine derivatives as potential c-Met inhibitors.

description: Small molecule binding data for protein AKT/p21CIP1, ALK tyrosine kinase receptor, AXL receptor tyrosine kinase, Cyclin-dependent kinase 2, EPHB1, Ephrin receptor, Ephrin type-A receptor 1 (EPHA1), Epidermal growth factor receptor, Epidermal growth factor receptor and ErbB2 (HER1 and HER2), Fibroblast growth factor receptor 1, Fibroblast growth factor receptor 2, Fibroblast growth factor receptor 3, Fibroblast growth factor receptor 4, Focal adhesion kinase 1/vascular endothelial growth factor receptor 3, Glycogen synthase kinase-3, Hepatocyte growth factor receptor, Insulin receptor, Insulin-like growth factor I receptor, JAK2/TYK2, JAK3/JAK1, Kinesin-1 heavy chain/ Tyrosine-protein kinase receptor RET, Leukocyte tyrosine kinase receptor, MAP kinase ERK2, Macrophage-stimulating protein receptor, Mitogen-activated protein kinase 14, Muscle, skeletal receptor tyrosine protein kinase, Neurotrophic tyrosine kinase receptor, Platelet-derived growth factor receptor, Platelet-derived growth factor receptor beta, Protein kinase C (PKC), Protein kinase C alpha type, Protein kinase N1, Protein kinase N2, Proto-oncogene tyrosine-protein kinase ROS, Receptor tyrosine-protein kinase erbB-4 (HER4), SRC, Serine/threonine-protein kinase Aurora, Tyrosine-protein kinase ABL, Tyrosine-protein kinase ABL1, Tyrosine-protein kinase BRK, Tyrosine-protein kinase BTK, Tyrosine-protein kinase FER, Tyrosine-protein kinase Fes/Fps, Tyrosine-protein kinase JAK1, Tyrosine-protein kinase JAK2, Tyrosine-protein kinase Kit (Kit), Tyrosine-protein kinase SYK, Tyrosine-protein kinase Yes, Tyrosine-protein kinase receptor FLT3, VEGF-receptor 2 and tyrosine-protein kinase SRC, Vascular endothelial growth factor receptor, Vascular endothelial growth factor receptor 2, Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2), and cAMP-dependent protein kinase (PKA), Uniprot L7RSL3, O14965, O15146, O60674, P00519, P00533, P04626, P04629, P06213, P06239, P06241, P07332, P07947, P07948, P07949, P08069, P08581, P08922, P09619, P10721, P11362, P12931, P16234, P16591, P17252, P17612, P17948, P21709, P21802, P21860, P22455, P22607, P23458, P24941, P28482, P29317, P29323, P29376, P29597, P30530, P31749, P35916, P35968, P36888, P42684, P43405, P49841, P52333, P54762, Q02763, Q04912, Q05513, Q06187, Q13882, Q15303, Q16512, Q16513, Q16539, and Q9UM73
DOI: 10.7270/q29p33n6
title: BindingDB Entry 50048211: Development of highly potent phosphodiesterase 4 inhibitors with anti-neuroinflammation potential: Design, synthesis, and structure-activity relationship study of catecholamides bearing aromatic rings.

description: Small molecule binding data for protein Phosphodiesterase 11A (PDE11A), Phosphodiesterase 1A (PDE1A), Phosphodiesterase 3 and 5 (PDE3 and PDE5), Phosphodiesterase 6C (PDE6C), Phosphodiesterase 7, Phosphodiesterase 8, Phosphodiesterase 9A, cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, cAMP-specific 3',5'-cyclic phosphodiesterase 4A, cAMP-specific 3',5'-cyclic phosphodiesterase 4B, cAMP-specific 3',5'-cyclic phosphodiesterase 4C, cAMP-specific 3',5'-cyclic phosphodiesterase 4D, cGMP-dependent 3',5'-cyclic phosphodiesterase, and cGMP-specific 3',5'-cyclic phosphodiesterase, Uniprot O00408, O60658, O76074, O76083, P27815, P51160, P54750, Q07343, Q08493, Q08499, Q13370, Q13946, Q9HCR9, and Q9Y233
DOI: 10.7270/q2f47r34
title: BindingDB Entry 50047675: Natural cholinesterase inhibitors from Myristica cinnamomea King.

description: Small molecule binding data for protein Acetylcholinesterase and Butyrylcholinesterase (BuChE), Uniprot P22303 and P81908
DOI: 10.7270/q2ff3vcj
title: BindingDB Entry 50048210: New piperidine-hydrazone derivatives: Synthesis, biological evaluations and molecular docking studies as AChE and BChE inhibitors.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot O42275 and P81908
DOI: 10.7270/q2hm5b9j
title: BindingDB Entry 50047170: Simple N(e)-thioacetyl-lysine-containing cyclic peptides exhibiting highly potent sirtuin inhibition.

description: Small molecule binding data for protein NAD-Dependent Deacetylase Sirtuin-1, NAD-dependent deacetylase sirtuin 2, and NAD-dependent protein deacetylase sirtuin-3 (SIRT3), Uniprot Q8IXJ6, Q96EB6, and Q9NTG7
DOI: 10.7270/q2jw8gt4
title: BindingDB Entry 50047674: Targeting the Motion of Shikimate Kinase: Development of Competitive Inhibitors that Stabilize an Inactive Open Conformation of the Enzyme.

description: Small molecule binding data for protein Shikimate kinase, Uniprot P56073
DOI: 10.7270/q2n87cpf
title: BindingDB Entry 50047169: Discovery of Benzo[cd]indol-2(1H)-ones as Potent and Specific BET Bromodomain Inhibitors: Structure-Based Virtual Screening, Optimization, and Biological Evaluation.

description: Small molecule binding data for protein Bromodomain-containing protein 3 and Bromodomain-containing protein 4, Uniprot O60885 and Q15059
DOI: 10.7270/q2pz5bt8
title: BindingDB Entry 50048208: Novel multi-target-directed ligands for Alzheimer's disease: Combining cholinesterase inhibitors and 5-HT

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 6 (5-HT6), Acetylcholinesterase, and Cholinesterase, Uniprot O42275, P06276, P22303, P50406, and P81908
DOI: 10.7270/q2s184cq
title: BindingDB Entry 50047168: Amorfrutin C Induces Apoptosis and Inhibits Proliferation in Colon Cancer Cells through Targeting Mitochondria.

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor, Peroxisome proliferator-activated receptor alpha (PPAR alpha), and Peroxisome proliferator-activated receptor delta (PPAR delta), Uniprot P37231, Q03181, and Q07869
DOI: 10.7270/q2ws8w46
title: BindingDB Entry 50047167: Converting maslinic acid into an effective inhibitor of acylcholinesterases.

description: Small molecule binding data for protein Acetylcholinesterase and Butyrylcholinesterase (BuChE), Uniprot O42275 and P81908
DOI: 10.7270/q20k2bf6
title: BindingDB Entry 50047174: Identification of potent and selective MTH1 inhibitors.

description: Small molecule binding data for protein MutT homolog 1 protein (MTH1), Uniprot P36639
DOI: 10.7270/q24b336c
title: BindingDB Entry 50047173: Tricyclic pyrazoles. Part 8. Synthesis, biological evaluation and modelling of tricyclic pyrazole carboxamides as potential CB2 receptor ligands with antagonist/inverse agonist properties.

description: Small molecule binding data for protein Cannabinoid receptor, Cannabinoid receptor 1, and Cannabinoid receptor 2, Uniprot P20272, P21554, and P34972
DOI: 10.7270/q2833tx9
title: BindingDB Entry 50047172: Identification of human telomerase inhibitors having the core of N-acyl-4,5-dihydropyrazole with anticancer effects.

description: Small molecule binding data for protein Telomerase reverse transcriptase, Uniprot O14746
DOI: 10.7270/q2cv4km8
title: BindingDB Entry 50047171: An NMR Biochemical Assay for Fragment-Based Drug Discovery: Evaluation of an Inhibitor Activity on Spermidine Synthase of Trypanosoma cruzi.

description: Small molecule binding data for protein Spermidine synthase and Trypanothione synthetase (TryS), Uniprot Q9GT49
DOI: 10.7270/q2d79dbm
title: BindingDB Entry 50047683: Dihydropyrimidones: As novel class ofß-glucuronidase inhibitors.

description: Small molecule binding data for protein Beta-glucuronidase (β-glucuronidase)
DOI: 10.7270/q2df6t6q
title: BindingDB Entry 50048218: Evaluation of the anti-malarial activity and cytotoxicity of 2,4-diamino-pyrimidine-based kinase inhibitors.

description: Small molecule binding data for protein Aurora kinase A/Targeting protein for Xklp2, Epidermal growth factor receptor, JAK2/JAK1, and JAK3/JAK1, Uniprot O14965, O60674, P00533, and P52333
DOI: 10.7270/q2hx1fmd
title: BindingDB Entry 50047682: Isomeric iodinated analogs of nimesulide: Synthesis, physicochemical characterization, cyclooxygenase-2 inhibitory activity, and transport across Caco-2 cells.

description: Small molecule binding data for protein Prostaglandin G/H synthase (Cyclooxygenase-2) and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P05979 and P79208
DOI: 10.7270/q2j67jx1
title: BindingDB Entry 50048217: [1,2]Oxazolo[5,4-e]isoindoles as promising tubulin polymerization inhibitors.

description: Small molecule binding data for protein Cyclin-Dependent Kinase 1 (CDK1), Uniprot P06493 and P14635
DOI: 10.7270/q2np26b4
title: BindingDB Entry 50047681: Design, synthesis, and biological evaluation of a novel series of peripheral-selective noradrenaline reuptake inhibitors - Part 3.

description: Small molecule binding data for protein Serotonin and norepinephrine transporters (SERT/NET), Sodium-dependent dopamine transporter, and Sodium-dependent noradrenaline transporter, Uniprot P23975, P31645, and Q01959
DOI: 10.7270/q2nz89nf
title: BindingDB Entry 50048216: Design and synthesis of chiral 2H-chromene-N-imidazolo-amino acid conjugates as aldose reductase inhibitors.

description: Small molecule binding data for protein Aldose reductase, Uniprot P07943
DOI: 10.7270/q2sf2z2g
title: BindingDB Entry 50047680: Synthetic sulfoglycolipids targeting the serine-threonine protein kinase Akt.

description: Small molecule binding data for protein AKT/p21CIP1, Uniprot P31749
DOI: 10.7270/q2sq92c5
title: BindingDB Entry 50048215: Synthesis and biological evaluation of new 6-hydroxypyridazinone benzisoxazoles: Potential multi-receptor-targeting atypical antipsychotics.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 6 (5-HT6), Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor, Histamine H1 receptor, and Serotonin (5-HT) receptor, Uniprot P08909, P14842, P19327, P31389, P50406, and P61169
DOI: 10.7270/q2vt1tzh
title: BindingDB Entry 50047175: New direct inhibitors of InhA with antimycobacterial activity based on a tetrahydropyran scaffold.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GLS2, Uniprot P40989
DOI: 10.7270/q2x63pvp
title: BindingDB Entry 50047679: Design and synthesis of dual 5-HT1A and 5-HT7 receptor ligands.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), 5-Hydroxytryptamine receptor 7 (5-HT7), 5-hydroxytryptamine receptor 1A, Dopamine receptor, Dopamine receptor D2L/neurotensin receptor NTS1, Histamine H1 receptor, Serotonin (5-HT) receptor, Serotonin and norepinephrine transporters (SERT/NET), and Serotonin receptor (2b and 2c), Uniprot P08908, P08909, P14416, P28223, P30729, P31645, P34969, P35367, P35462, and P41595
DOI: 10.7270/q2xg9t3h
title: BindingDB Entry 50048214: Pyrazole-based potent inhibitors of GGT1: Synthesis, biological evaluation, and molecular docking studies.

description: Small molecule binding data for protein Gamma-glutamyltranspeptidase 1, Uniprot P19440
DOI: 10.7270/q20z756p
title: BindingDB Entry 50047686: The design strategy of selective PTP1B inhibitors over TCPTP.

description: Small molecule binding data for protein Protein-tyrosine phosphatase 1B and T-cell protein-tyrosine phosphatase, Uniprot P17706 and P18031
DOI: 10.7270/q21838hv
title: BindingDB Entry 50048221: Synthesis of new donepezil analogues and investigation of their effects on cholinesterase enzymes.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot O42275