cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2930wp5
title: BindingDB Entry 50001365: An integrative study to identify novel scaffolds for sphingosine kinase 1 inhibitors.

description: Small molecule binding data for protein Sphingosine kinase 1 (SPHK1), Uniprot Q53ZR5 and Q9NYA1
DOI: 10.7270/q21j9d9v
title: BindingDB Entry 50001367: An update on small molecules targeting CXCR4 as starting points for the development of anti-cancer therapeutics.

description: Small molecule binding data for protein C-X-C chemokine receptor type 4, Uniprot P61073
DOI: 10.7270/q2s46vhg
title: BindingDB Entry 50001369: Meroterpenoids with Protein Tyrosine Phosphatase 1B Inhibitory Activity from a Hyrtios sp. Marine Sponge.

description: Small molecule binding data for protein Protein-tyrosine phosphatase 1B, Uniprot A8K3M3 and P18031
DOI: 10.7270/q2ww7m6f
title: BindingDB Entry 50001368: Novel 6-substituted benzoyl and non-benzoyl straight chain pyrrolo[2,3-d]pyrimidines as potential antitumor agents with multitargeted inhibition of TS, GARFTase and AICARFTase.

description: Small molecule binding data for protein Thymidylate synthase/GAR transformylase/AICAR transformylase, Uniprot P04818, P22102, P31939, Q53Y97, and V9HWH7
DOI: 10.7270/q2nc63q7
title: BindingDB Entry 50001371: Development of GLUT4-selective antagonists for multiple myeloma therapy.

description: Small molecule binding data for protein Glucose transporter, Solute carrier family 2, facilitated glucose transporter member 1, Solute carrier family 2, facilitated glucose transporter member 14, Solute carrier family 2, facilitated glucose transporter member 4, and Solute carrier family 2, facilitated glucose transporter member 8, Uniprot A0A024R871, P11166, P11167, P14672, P19357, Q8TDB8, and Q9NY64
DOI: 10.7270/q2cv4m7r
title: BindingDB Entry 50001375: Design of Selective Benzoxazepin PI3Kδ Inhibitors Through Control of Dihedral Angles.

description: Small molecule binding data for protein Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform/gamma isoform, Uniprot A0A2K8FKV1 and O00329
DOI: 10.7270/q2hm5bz2
title: BindingDB Entry 50001373: Discovery of new MD2-targeted anti-inflammatory compounds for the treatment of sepsis and acute lung injury.

description: Small molecule binding data for protein Lymphocyte antigen 96, Uniprot Q9Y6Y9
DOI: 10.7270/q2833vjs
title: BindingDB Entry 50001377: Discovery of BAZ2A bromodomain ligands.

description: Small molecule binding data for protein Bromodomain adjacent to zinc finger domain protein 2A and Bromodomain adjacent to zinc finger domain protein 2B, Uniprot Q9UIF8 and Q9UIF9
DOI: 10.7270/q24b33vw
title: BindingDB Entry 50001378: Dual Inhibition of Mnk2 and FLT3 for potential treatment of acute myeloid leukaemia.

description: Small molecule binding data for protein MAP kinase-interacting serine/threonine-protein kinase 1, MAP kinase-interacting serine/threonine-protein kinase 1/2, and Tyrosine-protein kinase receptor FLT3, Uniprot P36888, Q9BUB5, and Q9HBH9
DOI: 10.7270/q20p12hf
title: BindingDB Entry 50001379: Synthesis, in vitro β-glucuronidase inhibitory potential and molecular docking studies of quinolines.

description: Small molecule binding data for protein Beta-glucuronidase, Uniprot A3KMY8
DOI: 10.7270/q2vx0k15
title: BindingDB Entry 50001380: Study on the design, synthesis and structure-activity relationships of new thiosemicarbazone compounds as tyrosinase inhibitors.

description: Small molecule binding data for protein Tyrosinase, Uniprot O42713
DOI: 10.7270/q2r49t8r
title: BindingDB Entry 50001381: Synthesis and biological investigation of 2,4-substituted quinazolines as highly potent inhibitors of breast cancer resistance protein (ABCG2).

description: Small molecule binding data for protein ATP-binding cassette sub-family G member 2 and Multidrug resistance protein 1/Multidrug resistance associated protein 1, Uniprot A1LUE4, A4D1D2, P08183, P33527, and Q9UNQ0
DOI: 10.7270/q2mc92hz
title: BindingDB Entry 50001382: A novel class of thiosemicarbazones show multi-functional activity for the treatment of Alzheimer's disease.

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot O42275
DOI: 10.7270/q2bv7k4t
title: BindingDB Entry 50001385: Discovery of an Isothiazole-Based Phenylpropanoic Acid GPR120 Agonist as a Development Candidate for Type 2 Diabetes.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GLS2, Free fatty acid receptor 1, G-protein coupled receptor 120, and Omega-3 fatty acid receptor 1, Uniprot O14842, P40989, Q3V2S5, Q5NUL3, and Q7TMA4
DOI: 10.7270/q2736tfv
title: BindingDB Entry 50001386: Namalides B and C and Spumigins K-N from the Cultured Freshwater Cyanobacterium Sphaerospermopsis torques-reginae.

description: Small molecule binding data for protein Carboxypeptidase A1 and Thrombin and coagulation factor X, Uniprot P00730 and P00734
DOI: 10.7270/q2gm89s7
title: BindingDB Entry 50001383: Photoactivation provides a mechanistic explanation for pan-assay interference behaviour of 2-aminopyrroles in lipoxygenase inhibition.

description: Small molecule binding data for protein Arachidonate 15-lipoxygenase, Uniprot P16050
DOI: 10.7270/q23f4s59
title: BindingDB Entry 50001387: Mixed Aryl Phosphonate Prodrugs of a Butyrophilin Ligand.

description: Small molecule binding data for protein Butyrophilin subfamily 3 member A1, Uniprot O00481
DOI: 10.7270/q2zp48nj
title: BindingDB Entry 50001388: Design and Synthesis of

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A, Metabotropic glutamate receptor 3, and Metabotropic glutamate receptor 5, Uniprot B2CZC8, C1ID52, P05177, P08684, P10635, P11712, P31422, P31424, Q6GRK0, and S5RV20
DOI: 10.7270/q2tx3hwc
title: BindingDB Entry 50001389: 1-Aryl-1H- and 2-aryl-2H-1,2,3-triazole derivatives blockade P2X7 receptor in vitro and inflammatory response in vivo.

description: Small molecule binding data for protein P2X purinoceptor 7, Uniprot Q64663, Q8CHP4, Q99572, and Q9Z1M0
DOI: 10.7270/q2kd21dk
title: BindingDB Entry 50001391: Discovery of AZD-2098 and AZD-1678, Two Potent and Bioavailable CCR4 Receptor Antagonists.

description: Small molecule binding data for protein C-C chemokine receptor type 4, Uniprot A0N0Q1, P51679, P51680, and Q8MJW8
DOI: 10.7270/q2q52s4x
title: BindingDB Entry 50001390: Hydroxytriazole derivatives as potent and selective aldo-keto reductase 1C3 (AKR1C3) inhibitors discovered by bioisosteric scaffold hopping approach.

description: Small molecule binding data for protein Aldo-keto reductase family 1 member C2, Aldo-keto-reductase family 1 member C3, Cytochrome c oxidase subunit 2, and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P00403, P05979, P42330, P52895, and U5Z487,A0A1X7RBF7
DOI: 10.7270/q29z97dr
title: BindingDB Entry 50001393: Lipid Peroxidation and Cyclooxygenase Enzyme Inhibitory Compounds from Prangos haussknechtii.

description: Small molecule binding data for protein Prostaglandin E synthase/G/H synthase 2 and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P05979 and P35354
DOI: 10.7270/q2fn18q9
title: BindingDB Entry 50001392: Design, Synthesis, and Evaluation of Tetrahydropyrrolo[1,2-

description: Small molecule binding data for protein Core antigen, Uniprot Q03732
DOI: 10.7270/q2668gqs
title: BindingDB Entry 50001394: Acridone-pyrimidine hybrids- design, synthesis, cytotoxicity studies in resistant and sensitive cancer cells and molecular docking studies.

description: Small molecule binding data for protein RAC-alpha serine/threonine-protein kinase AKT1, Uniprot B0LPE5 and P31749
DOI: 10.7270/q2xp77gq
title: BindingDB Entry 50001396: Acetylcholinesterase Inhibitory Alkaloids from the Whole Plants of Zephyranthes carinata.

description: Small molecule binding data for protein Cholinesterases; ACHE & BCHE, Uniprot P22303
DOI: 10.7270/q22f7r0g
title: BindingDB Entry 50001395: 6-Cyano Analogues of Bedaquiline as Less Lipophilic and Potentially Safer Diarylquinolines for Tuberculosis.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GLS2, Uniprot P40989
DOI: 10.7270/q2sx6gr0
title: BindingDB Entry 50001397: Discovery of CDZ173 (Leniolisib), Representing a Structurally Novel Class of PI3K Delta-Selective Inhibitors.

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 2B, CREB-binding protein/p53, DNA-dependent protein kinase, Peptidyl-prolyl cis-trans isomerase FKBP1B/Serine/threonine-protein kinase mTOR, Phosphatidylinositol 3-kinase catalytic subunit type 3, Phosphatidylinositol 3-kinase regulatory subunit beta/Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform/[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform/gamma isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, Phosphatidylinositol 4-kinase beta, and cAMP-specific 3',5'-cyclic phosphodiesterase 4D, Uniprot A0A024R720, A0A140VJR0, A0A2K8FKV1, K7PPA8, O00329, O35904, P04637, P41595, P42336, P42338, P42345, P48736, P78527, Q08499, Q8NEB9, Q9JHG7, and Q9UBF8
DOI: 10.7270/q2p55r10
title: BindingDB Entry 50001398: Berchemiosides A-C, 2-Acetoxy-ω-phenylpentaene Fatty Acid Triglycosides from the Unripe Fruits of Berchemia berchemiifolia.

description: Small molecule binding data for protein Xanthine dehydrogenase, Uniprot P47989
DOI: 10.7270/q2dr2z08
title: BindingDB Entry 50001400: Discovery of Benzo[g]quinazolin benzenesulfonamide derivatives as dual EGFR/HER2 inhibitors.

description: Small molecule binding data for protein Epidermal growth factor receptor and Receptor tyrosine-protein kinase erbB-2, Uniprot P00533, P04626, and X5DNK3
DOI: 10.7270/q290269p
title: BindingDB Entry 50001401: New chemotype of selective and potent inhibitors of human delta 24-dehydrocholesterol reductase.

description: Small molecule binding data for protein Delta(24)-sterol reductase, Uniprot Q15392
DOI: 10.7270/q2jd50b3
title: BindingDB Entry 50001399: Crassiflorone derivatives that inhibit Trypanosoma brucei glyceraldehyde-3-phosphate dehydrogenase (TbGAPDH) and Trypanosoma cruzi trypanothione reductase (TcTR) and display trypanocidal activity.

description: Small molecule binding data for protein Trypanothione reductase, Uniprot A0A2V2X955 and P28593
DOI: 10.7270/q2571fjh
title: BindingDB Entry 50001402: C-Methylated Flavonoid Glycosides from Pentarhizidium orientale Rhizomes and Their Inhibitory Effects on the H1N1 Influenza Virus.

description: Small molecule binding data for protein Neuraminidase, Uniprot P03468
DOI: 10.7270/q21g0psb
title: BindingDB Entry 50001403: Design, synthesis and structure-activity relationship studies of a focused library of pyrimidine moiety with anti-proliferative and anti-metastasis activities in triple negative breast cancer.

description: Small molecule binding data for protein VEGF-receptor 2 and PDGF-receptor beta (KDR and PDGFR beta), Uniprot P09619
DOI: 10.7270/q2rx9fk5
title: BindingDB Entry 50001405: Potential Anti-inflammatory Effects of the Fruits of Paulownia tomentosa.

description: Small molecule binding data for protein Leukocyte elastase, Uniprot P08246
DOI: 10.7270/q2wq069f
title: BindingDB Entry 50001404: Targeting breast cancer stem cells by novel HDAC3-selective inhibitors.

description: Small molecule binding data for protein Histone deacetylase 1, Histone deacetylase 2, and Histone deacetylase 3/Nuclear receptor corepressor 2, Uniprot O15379, Q13547, Q6IT96, Q92769, and Q9Y618
DOI: 10.7270/q2n58pw6
title: BindingDB Entry 50001406: Design, synthesis and biological evaluations of N-Hydroxy thienopyrimidine-2,4-diones as inhibitors of HIV reverse transcriptase-associated RNase H.

description: Small molecule binding data for protein Gag-Pol polyprotein, Human immunodeficiency virus type 1 reverse transcriptase, and Integrase, Uniprot F2WR39,F2WR52,Q76353, P04585, and Q72547
DOI: 10.7270/q2cr5wwx
title: BindingDB Entry 50001408: Synthesis of naphthazarin derivatives and identification of novel thioredoxin reductase inhibitor as potential anticancer agent.

description: Small molecule binding data for protein Thioredoxin reductase 1 (TrxR) and Thioredoxin reductase 1, cytoplasmic, Uniprot O89049 and Q16881,A0A087WSY9
DOI: 10.7270/q2hh6nk6
title: BindingDB Entry 50001407: Design and synthesis of tranylcypromine derivatives as novel LSD1/HDACs dual inhibitors for cancer treatment.

description: Small molecule binding data for protein Amine oxidase (flavin-containing) A, Amine oxidase [flavin-containing] B, Histone deacetylase 1, Histone deacetylase 2, Histone deacetylase 5, and Lysine-specific histone demethylase 1A, Uniprot O60341, P21397, P27338, Q13547, Q53YE7, Q6IT96, Q92769, and Q9UQL6
DOI: 10.7270/q280554v
title: BindingDB Entry 50001409: Design, synthesis and biological evaluation of 4,7,12,12a-tetrahydro-5H-thieno[3',2':3,4]pyrido[1,2-b]isoquinolines as novel adenosine 5'-monophosphate-activated protein kinase (AMPK) indirect activators for the treatment of type 2 diabetes.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GLS2, Uniprot P40989
DOI: 10.7270/q20g3nnz
title: BindingDB Entry 50001412: Fragment-based approach to identify IDO1 inhibitor building blocks.

description: Small molecule binding data for protein Indoleamine 2,3-dioxygenase, Uniprot A0A348GSI3 and P14902
DOI: 10.7270/q2474dcp
title: BindingDB Entry 50001410: Tying up tranylcypromine: Novel selective histone lysine specific demethylase 1 (LSD1) inhibitors.

description: Small molecule binding data for protein Amine oxidase (flavin-containing) A, Amine oxidase [flavin-containing] B, Lysine-specific histone demethylase 1A, and Lysine-specific histone demethylase 1B, Uniprot O60341, P21397, P27338, Q53YE7, and Q8NB78
DOI: 10.7270/q2vq3552
title: BindingDB Entry 50001413: Resorcinol-Based Grp94-Selective Inhibitors.

description: Small molecule binding data for protein Heat shock protein 90 beta and Heat shock protein HSP 90-alpha, Uniprot K9JA46, P07900, and P41148
DOI: 10.7270/q2m90c6j
title: BindingDB Entry 50001415: Improved proteolytic stability and potent activity against Leishmania infantum trypanothione reductase of α/β-peptide foldamers conjugated to cell-penetrating peptides.

description: Small molecule binding data for protein Trypanothione reductase, Uniprot A0A5K1USX6,A4HSF7
DOI: 10.7270/q2qz2dgs
title: BindingDB Entry 50001414: Serendipitous discovery of potent human head and neck squamous cell carcinoma anti-cancer molecules: A fortunate failure of a rational molecular design.

description: Small molecule binding data for protein Histone deacetylase and Histone deacetylase 8, Uniprot A0A024QZ26, O15379, P56524, Q13547, Q6IT96, Q8WUI4, Q92769, Q969S8, Q96DB2, Q9BY41, Q9UBN7, Q9UKV0, and Q9UQL6
DOI: 10.7270/q2br8vq3
title: BindingDB Entry 50001417: Novel SERMs based on 3-aryl-4-aryloxy-2H-chromen-2-one skeleton - A possible way to dual ERα/VEGFR-2 ligands for treatment of breast cancer.

description: Small molecule binding data for protein Baculoviral IAP repeat-containing protein 2/Estrogen receptor, Uniprot G4XH65 and P03372
DOI: 10.7270/q2gh9mhq
title: BindingDB Entry 50001416: Scalaradial Is a Potent Inhibitor of Transient Receptor Potential Melastatin 2 (TRPM2) Ion Channels.

description: Small molecule binding data for protein Phospholipase A2 (Bee), Transient receptor potential cation channel subfamily M member 2, and Transient receptor potential cation channel subfamily M member 7, Uniprot B7UUK1, E9PTA2, O94759, P00630, and Q923J1
DOI: 10.7270/q27083zm
title: BindingDB Entry 50001418: New pyridine derivatives as inhibitors of acetylcholinesterase and amyloid aggregation.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterases; ACHE & BCHE, Uniprot O42275, P06276, and P22303
DOI: 10.7270/q2377c79
title: BindingDB Entry 50001419: Nature-based molecules combined with rivastigmine: A symbiotic approach for the synthesis of new agents against Alzheimer's disease.

description: Small molecule binding data for protein Cholinesterases; ACHE & BCHE, Uniprot P06276
DOI: 10.7270/q2zg6vrm
title: BindingDB Entry 50001420: Discovery of thienopyrrolotriazine derivatives to protect mitochondrial function against Aβ-induced neurotoxicity.

description: Small molecule binding data for protein Benzodiazepine receptors; peripheral & central and Translocator protein, Uniprot P16257 and P30536
DOI: 10.7270/q2tq6424
title: BindingDB Entry 50001421: Artificial Macrocycles as Potent p53-MDM2 Inhibitors.

description: Small molecule binding data for protein MDM2-MDMX, Uniprot Q00987
DOI: 10.7270/q2q242r1
title: BindingDB Entry 50001422: Discovery of new indomethacin-based analogs with potentially selective cyclooxygenase-2 inhibition and observed diminishing to PGE2 activities.

description: Small molecule binding data for protein Cyclooxygenase and Prostaglandin E synthase/G/H synthase 2, Uniprot P23219, P35354, P35355, and Q63921
DOI: 10.7270/q2k93b25
title: BindingDB Entry 50001423: Lucky Switcheroo: Dramatic Potency and Selectivity Improvement of Imidazoline Inhibitors of Human Carbonic Anhydrase VII.

description: Small molecule binding data for protein Isocitrate dehydrogenase 2 (IDH2) and Isocitrate dehydrogenase [NADP] cytoplasmic, Uniprot A0A024R3Y6, O75874, and P48735
DOI: 10.7270/q2fj2k90
title: BindingDB Entry 50001424: Design, synthesis and biological evaluation of N-(4-alkoxy-3-cyanophenyl)isonicotinamide/nicotinamide derivatives as novel xanthine oxidase inhibitors.

description: Small molecule binding data for protein Xanthine dehydrogenase, Uniprot P80457
DOI: 10.7270/q26112ts
title: BindingDB Entry 50001426: Therapeutic investigations of novel indoxyl-based indolines: A drug target validation and Structure-Activity Relationship of angiotensin-converting enzyme inhibitors with cardiovascular regulation and thrombolytic potential.

description: Small molecule binding data for protein Angiotensin-converting enzyme, Uniprot P12821
DOI: 10.7270/q29s1tjt
title: BindingDB Entry 50001425: A pentanoic acid derivative targeting matrix metalloproteinase-2 (MMP-2) induces apoptosis in a chronic myeloid leukemia cell line.

description: Small molecule binding data for protein 72 kDa type IV collagenase, Collagenase, Interstitial collagenase, Matrix metalloproteinase 12, Matrix metalloproteinase 14, and Matrix metalloproteinase-9, Uniprot A0A024R6R4, P03956, P08253, P14780, P22894, P39900, and P50281
DOI: 10.7270/q2280b3g
title: BindingDB Entry 50001427: Synthesis and Pharmacological Evaluation of Selective Histone Deacetylase 6 Inhibitors in Melanoma Models.

description: Small molecule binding data for protein Histone deacetylase 1 and Histone deacetylase 6, Uniprot A0A024QZ26, Q13547, Q6IT96, and Q9UBN7
DOI: 10.7270/q2st7sbp
title: BindingDB Entry 50001431: Identification of Potent and Selective RIPK2 Inhibitors for the Treatment of Inflammatory Diseases.

description: Small molecule binding data for protein Receptor-interacting serine/threonine-protein kinase 2, SRC, Serine/threonine-protein kinase RIPK2, and Tyrosine-protein kinase Lyn, Uniprot A0A0S2Z3Y8, A0A0S2Z4Z8, G3V783, O43353, P06239, P07948, P58801, and Q547H1
DOI: 10.7270/q2xg9tnp
title: BindingDB Entry 50001428: Targeting the Allosteric Site of Oncoprotein BCR-ABL as an Alternative Strategy for Effective Target Protein Degradation.

description: Small molecule binding data for protein Baculoviral IAP repeat-containing protein 2, Baculoviral IAP repeat-containing protein 3 (IAP1 BIR3), Tyrosine-protein kinase ABL1, and X-linked inhibitor of apoptosis protein (XIAP), Uniprot A0A024R8E2, P00519, P98170, Q13489, and Q13490
DOI: 10.7270/q2p271n3
title: BindingDB Entry 50001432: Camellianols A-G, Barrigenol-like Triterpenoids with PTP1B Inhibitory Effects from the Endangered Ornamental Plant Camellia crapnelliana.

description: Small molecule binding data for protein Protein-tyrosine phosphatase 1B, Uniprot A8K3M3 and P18031
DOI: 10.7270/q2dj5j45
title: BindingDB Entry 50001434: Multifunctional iminochromene-2H-carboxamide derivatives containing different aminomethylene triazole with BACE1 inhibitory, neuroprotective and metal chelating properties targeting Alzheimer's disease.

description: Small molecule binding data for protein Beta-secretase (BACE), Uniprot A0A024R3D7 and P56817
DOI: 10.7270/q2j968wx
title: BindingDB Entry 50001433: Novel ureidopropanamide based N-formyl peptide receptor 2 (FPR2) agonists with potential application for central nervous system disorders characterized by neuroinflammation.

description: Small molecule binding data for protein N-formyl peptide receptor 2 and fMet-Leu-Phe receptor 1/2, Uniprot A0A024R4P3, P21462, and P25090
DOI: 10.7270/q28s4sdf
title: BindingDB Entry 50001435: From PIM1 to PI3Kδ via GSK3β: Target Hopping through the Kinome.

description: Small molecule binding data for protein Axin-1/Glycogen synthase kinase-3 beta, PIK3CG/PIK3R1, Phosphatidylinositol 3-kinase regulatory subunit beta/Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform/[Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform/gamma isoform, and Serine/threonine-protein kinase pim-1, Uniprot A0A024R720, A0A024RD25, A0A2K8FKV1, O00329, P11309, P42336, P42338, P48736, P49841, and Q6FI27
DOI: 10.7270/q25141qv
title: BindingDB Entry 50001438: Lucky Switcheroo: Dramatic Potency and Selectivity Improvement of Imidazoline Inhibitors of Human Carbonic Anhydrase VII.

description: Small molecule binding data for protein Carbonic anhydrase and Carbonic anhydrases; II & IX, Uniprot P00915, P00918, P22748, P43166, V9HW21, and V9HWE3
DOI: 10.7270/q2183910
title: BindingDB Entry 50001439: Mtb PKNA/PKNB Dual Inhibition Provides Selectivity Advantages for Inhibitor Design To Minimize Host Kinase Interactions.

description: Small molecule binding data for protein Axin-1/Glycogen synthase kinase-3 beta, Cyclin-Dependent Kinase 2 (CDK2), Proto-oncogene tyrosine-protein kinase Src, Serine/threonine-protein kinase PknA, and Serine/threonine-protein kinase pknB, Uniprot A0A024RB77, P12931, P20248, P24941, P49841, P9WI81, P9WI83, and Q6FI27
DOI: 10.7270/q2wm1gx5
title: BindingDB Entry 50001440: Discovery of a Tetrahydrobenzisoxazole Series of γ-Secretase Modulators.

description: Small molecule binding data for protein Gamma-Secretase Subunit APH-1A/Gamma-Secretase Subunit PEN-2/Gamma-Secretase Subunit Presenilin-1/Gamma-secretase subunit APH-1B/Nicastrin /Presenilin 2 and Presenilin-1, Uniprot A0A024R6A3, P49768, P49810, Q8WW43, Q92542, Q96BI3, and Q9NZ42
DOI: 10.7270/q2n300gt
title: BindingDB Entry 50001442: 2-Arylidene Hydrazinecarbodithioates as Potent, Selective Inhibitors of Cystathionine γ-Lyase (CSE).

description: Small molecule binding data for protein Cystathionine gamma-lyase, Uniprot P32929
DOI: 10.7270/q2rv0r79
title: BindingDB Entry 50001441: Targeted Isolation of Monoterpene Indole Alkaloids from Palicourea sessilis.

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