cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2bg2p68
title: BindingDB Entry 50031982: Complementarity between a docking and a high-throughput screen in discovering new cruzain inhibitors.

description: Small molecule binding data for protein Cruzipain, Uniprot P25779
DOI: 10.7270/q2db81vf
title: BindingDB Entry 50030018: TBA

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor, Uniprot P37231
DOI: 10.7270/q2f76cpv
title: BindingDB Entry 50031008: Towards development of selective and reversible pyrazoline based MAO-inhibitors: Synthesis, biological evaluation and docking studies.

description: Small molecule binding data for protein Monoamine Oxidase Type B (MAO-B) and Monoamine oxidase, Uniprot P19643 and P21396
DOI: 10.7270/q2fx79c8
title: BindingDB Entry 50028984: TBA

description: Small molecule binding data for protein Leukocyte elastase, Uniprot P08246
DOI: 10.7270/q2g73dt7
title: BindingDB Entry 50030999: Novel lead for potent inhibitors of breast cancer resistance protein (BCRP).

description: Small molecule binding data for protein ATP-binding cassette sub-family G member 2 and Multidrug resistance-associated protein 1, Uniprot P33527 and Q9UNQ0
DOI: 10.7270/q2g73dxk
title: BindingDB Entry 50031981: Discovery and optimization of boronic acid based inhibitors of autotaxin.

description: Small molecule binding data for protein Autotaxin, Uniprot Q13822
DOI: 10.7270/q2j38sks
title: BindingDB Entry 50030017: TBA

description: Small molecule binding data for protein P-selectin/P-selectin glycoprotein ligand 1, Uniprot P16109
DOI: 10.7270/q2jq10zr
title: BindingDB Entry 50028997: TBA

description: Small molecule binding data for protein Muscarinic acetylcholine receptor M1, Uniprot P08482 and P11229
DOI: 10.7270/q2m045n9
title: BindingDB Entry 50031978: Computer-aided identification of Trypanosoma brucei uridine diphosphate galactose 4'-epimerase inhibitors: toward the development of novel therapies for African sleeping sickness.

description: Small molecule binding data for protein UDP-galactose 4-epimerase, Uniprot Q8T8E9
DOI: 10.7270/q2nv9j8r
title: BindingDB Entry 50030015: TBA

description: Small molecule binding data for protein Matrix metalloproteinase-1 (MMP1), Uniprot P03956
DOI: 10.7270/q2pg1rnn
title: BindingDB Entry 50028995: TBA

description: Small molecule binding data for protein Muscarinic acetylcholine receptor, Muscarinic acetylcholine receptor M1, and Muscarinic acetylcholine receptor M2, Uniprot P08172, P08482, P08483, P08485, P08911, P10980, P11229, and P20309
DOI: 10.7270/q2qr4x9f
title: BindingDB Entry 50031977: Selective hexapeptide agonists and antagonists for human complement C3a receptor.

description: Small molecule binding data for protein C3a anaphylatoxin chemotactic receptor and C5a anaphylatoxin chemotactic receptor (C5aR), Uniprot P21730 and Q16581
DOI: 10.7270/q2sn08z5
title: BindingDB Entry 50030013: TBA

description: Small molecule binding data for protein Protein Farnesyltransferase (PFT) and Squalene synthetase, Uniprot P37268, P49354, and P49356
DOI: 10.7270/q2t72hbx
title: BindingDB Entry 50028993: TBA

description: Small molecule binding data for protein Muscarinic acetylcholine receptor and Muscarinic acetylcholine receptor M1, Uniprot P08482, P08483, P08485, P08911, and P10980
DOI: 10.7270/q2td9xfm
title: BindingDB Entry 50031005: Discovery of benzimidazole-diamide finger loop (Thumb Pocket I) allosteric inhibitors of HCV NS5B polymerase: Implementing parallel synthesis for rapid linker optimization.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), and Cytochrome P450 3A, Uniprot P05177, P08684, P10635, P11712, and P33261
DOI: 10.7270/q2vd6znw
title: BindingDB Entry 50031976: Selective synthesis and biological evaluation of sulfate-conjugated resveratrol metabolites.

description: Small molecule binding data for protein Cyclooxygenase, Nitric Oxide Synthase, inducible, and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P05979, P29477, and P35354
DOI: 10.7270/q2x92b91
title: BindingDB Entry 50030012: TBA

description: Small molecule binding data for protein Coagulation factor X/antithrombin III, Prothrombin, and Trypsin-1, Uniprot P00734, P00742, and P07477
DOI: 10.7270/q2z0382n
title: BindingDB Entry 50028992: TBA

description: Small molecule binding data for protein Muscarinic acetylcholine receptor, Muscarinic acetylcholine receptor M1, and Muscarinic receptor M2 and M3, Uniprot P08482, P08483, P08485, P08911, P10980, and P11229
DOI: 10.7270/q2z60p5w
title: BindingDB Entry 50031004: Pyrrole derivatives as potent inhibitors of lymphocyte-specific kinase: Structure, synthesis, and SAR.

description: Small molecule binding data for protein AKT/p21CIP1, Cyclin-dependent kinase 1, Dual specificity mitogen-activated protein kinase kinase 1, Tyrosine-protein kinase ABL1, Tyrosine-protein kinase CSK, Tyrosine-protein kinase ZAP-70, and VEGF-receptor 2 and tyrosine-protein kinase SRC, Uniprot P00519, P06493, P12931, P31749, P41240, P43403, and Q02750
DOI: 10.7270/q2154h1t
title: BindingDB Entry 50030022: TBA

description: Small molecule binding data for protein Neurokinin 1 receptor and Neurokinin 2 receptor, Uniprot P30547 and P30549
DOI: 10.7270/q21r6qdv
title: BindingDB Entry 50029001: TBA

description: Small molecule binding data for protein Acetylcholinesterase and Acetylcholinesterase and butyrylcholinesterase (AChE and BChE), Uniprot P21836 and P37136
DOI: 10.7270/q21z44hg
title: BindingDB Entry 50031011: Synthesis and anticancer activities of ageladine A and structural analogs.

description: Small molecule binding data for protein Collagenase, Uniprot P08253
DOI: 10.7270/q21z44mt
title: BindingDB Entry 50031993: Identification of glycosylated exendin-4 analogue with prolonged blood glucose-lowering activity through glycosylation scanning substitution.

description: Small molecule binding data for protein Glucagon-like peptide 1 receptor (GLP-1), Uniprot P43220
DOI: 10.7270/q23x86mf
title: BindingDB Entry 50030031: TBA

description: Small molecule binding data for protein Epidermal growth factor receptor, PDGFR-beta/Platelet-derived growth factor receptor alpha, Protein kinase C alpha type, Protein kinase C delta type, Tyrosine-protein kinase ABL1, VEGF-receptor 2 and tyrosine-protein kinase SRC, and cAMP-dependent protein kinase (PKA), Uniprot P00519, P00533, P09619, P12931, P16234, P17252, P17612, P22612, P22694, and Q05655
DOI: 10.7270/q24t6jdd
title: BindingDB Entry 50030021: TBA

description: Small molecule binding data for protein Voltage-gated calcium channel, Uniprot Q13936
DOI: 10.7270/q25h7g51
title: BindingDB Entry 50029000: TBA

description: Small molecule binding data for protein Acetylcholinesterase, Uniprot P37136
DOI: 10.7270/q25q4w6c
title: BindingDB Entry 50031010: Synthesis and biological activity of 5-styryl and 5-phenethyl-substituted 2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indoles.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 6 (5-HT6) and Histamine H1 receptor, Uniprot P35367 and P50406
DOI: 10.7270/q25q4w88
title: BindingDB Entry 50031992: Aryl sulfonamides containing tetralin allylic amines as potent and selective bradykinin B1 receptor antagonists.

description: Small molecule binding data for protein Bradykinin B1 receptor, Uniprot P46663
DOI: 10.7270/q27m07zf
title: BindingDB Entry 50030029: TBA

description: Small molecule binding data for protein Cholecystokinin receptor, Uniprot P30551 and P32239
DOI: 10.7270/q29886xs
title: BindingDB Entry 50028999: TBA

description: Small molecule binding data for protein Acetylcholinesterase and Butyrylcholinesterase (BChE), Uniprot O42275, P22303, and Q9N1N9
DOI: 10.7270/q29g5mxp
title: BindingDB Entry 50031009: The discovery of tetrahydro-beta-carbolines as inhibitors of the kinesin Eg5.

description: Small molecule binding data for protein Kinesin-like protein 1, Uniprot P52732
DOI: 10.7270/q29g5n00
title: BindingDB Entry 50031991: A specific and direct comparison of the trifluoromethyl and pentafluoro sulfanyl groups on the selective dopamine D(3) antagonist 3-(3-{[4-methyl-5-(4-methyl-1,3-oxazol-5-yl)-4H-1,2,4-triazol-3-yl]thio}propyl)-1-phenyl-3-azabicyclo[3.1.0]hexane template.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, and Voltage-gated potassium channel, Uniprot P05177, P08684, P10635, P11712, P33261, and Q12809
DOI: 10.7270/q2cc10p5
title: BindingDB Entry 50030028: TBA

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot P06276 and P37136
DOI: 10.7270/q2d21xjr
title: BindingDB Entry 50029007: TBA

description: Small molecule binding data for protein Cysteinyl leukotriene receptor 1, Uniprot Q2NNR5
DOI: 10.7270/q2f18zmp
title: BindingDB Entry 50028998: TBA

description: Small molecule binding data for protein Muscarinic acetylcholine receptor M1 and Muscarinic receptor M2 and M3, Uniprot P08482 and P10980
DOI: 10.7270/q2f76crr
title: BindingDB Entry 50031990: 5-Lipoxygenase-activating protein inhibitors. Part 3: 3-{3-tert-Butylsulfanyl-1-[4-(5-methoxy-pyrimidin-2-yl)-benzyl]-5-(5-methyl-pyridin-2-ylmethoxy)-1H-indol-2-yl]-2,2-dimethyl-propionic acid (AM643)-A potent FLAP inhibitor suitable for topical administration.

description: Small molecule binding data for protein 5-lipoxygenase/FLAP, Cyclooxygenase, Cyclooxygenase-1 (COX-1), Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), and Cytochrome P450 3A, Uniprot P08684, P10635, P11712, P20292, P23219, and P35354
DOI: 10.7270/q2h41rfz
title: BindingDB Entry 50030026: TBA

description: Small molecule binding data for protein SRC, Uniprot P06241
DOI: 10.7270/q2k074c4
title: BindingDB Entry 50031007: Oxime derivatives related to AP18: Agonists and antagonists of the TRPA1 receptor.

description: Small molecule binding data for protein Transient receptor potential cation channel subfamily A member 1, Uniprot O75762
DOI: 10.7270/q2k074gg
title: BindingDB Entry 50031989: Insights into binding modes of adenosine A(2B) antagonists with ligand-based and receptor-based methods.

description: Small molecule binding data for protein Adenosine Receptors A2a (A2a), Adenosine receptor A1, Adenosine receptor A2a, Adenosine receptor A2b, and Adenosine receptor A3, Uniprot P0DMS8, P25099, P29274, P29275, P30542, and P30543
DOI: 10.7270/q2mw2h5c
title: BindingDB Entry 50030025: TBA

description: Small molecule binding data for protein Progesterone receptor, Uniprot P06186
DOI: 10.7270/q2ng4qjq
title: BindingDB Entry 50029004: TBA

description: Small molecule binding data for protein HMG-CoA reductase, Uniprot P04035, P51639, and Q01237
DOI: 10.7270/q2ns0v0s
title: BindingDB Entry 50031015: Oxo-bridged isomers of aza-trishomocubane sigma (sigma) receptor ligands: Synthesis, in vitro binding, and molecular modeling.

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 1A, Alpha-2C adrenergic receptor, Sigma, Sodium-dependent dopamine transporter, and Sodium-dependent noradrenaline transporter, Uniprot P08908, P18825, P23975, Q01959, Q4W594, and Q99720
DOI: 10.7270/q2pn95rq
title: BindingDB Entry 50031006: A novel chemotype of kinase inhibitors: Discovery of 3,4-ring fused 7-azaindoles and deazapurines as potent JAK2 inhibitors.

description: Small molecule binding data for protein Tyrosine-protein kinase JAK2, Uniprot O60674
DOI: 10.7270/q2pr7w6h
title: BindingDB Entry 50031988: Synthesis and evaluation of a new series of Neuropeptide S receptor antagonists.

description: Small molecule binding data for protein Neuropeptide S receptor, Uniprot Q6W5P4
DOI: 10.7270/q2rn37wp
title: BindingDB Entry 50030024: TBA

description: Small molecule binding data for protein Protein Farnesyltransferase (PFT), Uniprot P49354 and P49356
DOI: 10.7270/q2s75g70
title: BindingDB Entry 50029003: TBA

description: Small molecule binding data for protein Arachidonate 5-lipoxygenase, Cyclooxygenase, and Phospholipase A2, membrane associated, Uniprot O62664, O62698, P12527, and P14555
DOI: 10.7270/q2sf2w8b
title: BindingDB Entry 50031014: Coumarins as novel 17beta-hydroxysteroid dehydrogenase type 3 inhibitors for potential treatment of prostate cancer.

description: Small molecule binding data for protein 17-beta-hydroxysteroid dehydrogenase type 3, Androgen Receptor, and Estradiol receptor alpha (ERα), Uniprot P03372, P10275, and P37058
DOI: 10.7270/q2sj1ktf
title: BindingDB Entry 50031996: 4-(3-Trifluoromethylphenyl)-pyrimidine-2-carbonitrile as cathepsin S inhibitors: N3, not N1 is critically important.

description: Small molecule binding data for protein Cathepsin K and Cathepsin S, Uniprot P25774 and P43235
DOI: 10.7270/q2th8mwc
title: BindingDB Entry 50031987: Novel 8-arylated purines as inhibitors of glycogen synthase kinase.

description: Small molecule binding data for protein Casein Kinase II, Casein kinase I isoform alpha (CK1 Alpha), Epidermal growth factor receptor, Glycogen synthase kinase-3, Insulin-like growth factor I receptor, MAP kinase-activated protein kinase 2, Mitogen-activated protein kinase 3, Tyrosine-protein kinase receptor TYRO3, and c-Jun N-terminal kinase, JNK, Uniprot P00533, P08069, P27361, P45983, P48729, P49137, P49841, P68400, and Q06418
DOI: 10.7270/q2wd40kz
title: BindingDB Entry 50030023: TBA

description: Small molecule binding data for protein Integrin alpha-IIb/beta-3, Uniprot P05106 and P08514
DOI: 10.7270/q2x066xv
title: BindingDB Entry 50029002: TBA

description: Small molecule binding data for protein Coagulation factor X, Plasma kallikrein (KLKB1), Plasminogen, Thrombin, and Trypsin, Uniprot P00735, P00743, P00747, P00760, and P03952
DOI: 10.7270/q2x63n1h
title: BindingDB Entry 50031013: Novel imidazolopyrimidines as dual PI3-Kinase/mTOR inhibitors.

description: Small molecule binding data for protein PI3-kinase subunit alpha, PI3-kinase subunit gamma, and Serine/threonine-protein kinase mTOR, Uniprot P42336, P42345, and P48736
DOI: 10.7270/q2x92bg8
title: BindingDB Entry 50031994: Celecoxib prodrugs possessing a diazen-1-ium-1,2-diolate nitric oxide donor moiety: synthesis, biological evaluation and nitric oxide release studies.

description: Small molecule binding data for protein Cyclooxygenase and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P05979 and P35354
DOI: 10.7270/q2z60p87
title: BindingDB Entry 50031986: Fast-forwarding hit to lead: aurora and epidermal growth factor receptor kinase inhibitor lead identification.

description: Small molecule binding data for protein Epidermal growth factor receptor and Serine/threonine-protein kinase Aurora, Uniprot O14965 and P00533
DOI: 10.7270/q2057fxg
title: BindingDB Entry 50030032: TBA

description: Small molecule binding data for protein Collagenase, Matrix metalloproteinase 2/9, Matrix metalloproteinase-1 (MMP1), Matrix metalloproteinase-7 (MMP7), and Stromelysin-1, Uniprot P03956, P08253, P08254, P09237, and P14780
DOI: 10.7270/q20r9p9x
title: BindingDB Entry 50029010: TBA

description: Small molecule binding data for protein Prostanoid TP receptor, Uniprot P21731
DOI: 10.7270/q20z73bn
title: BindingDB Entry 50031021: Discovery and initial optimization of 5,5'-disubstituted aminohydantoins as potent beta-secretase (BACE1) inhibitors.

description: Small molecule binding data for protein Beta amyloid A4 protein, Beta-secretase 1, Beta-secretase 2 (BACE2), and Cathepsin D, Uniprot P05067, P07339, P56817, and Q9Y5Z0
DOI: 10.7270/q2125sv7
title: BindingDB Entry 50032003: Synthesis and pharmacological evaluation of aryl aminosulfonamide derivatives as potent 5-HT(6) receptor antagonists.

description: Small molecule binding data for protein Cytochrome P450 2D6 (2D6) and Cytochrome P450 3A, Uniprot P08684 and P10635
DOI: 10.7270/q22z15kz
title: BindingDB Entry 50030045: TBA

description: Small molecule binding data for protein Calcitonin gene-related peptide type 1 receptor, Uniprot Q16602
DOI: 10.7270/q24j0f16
title: BindingDB Entry 50029009: TBA

description: Small molecule binding data for protein Glucagon receptor, Uniprot P30082
DOI: 10.7270/q24q7v20
title: BindingDB Entry 50031020: Optimization of orally bioavailable alkyl amine renin inhibitors.

description: Small molecule binding data for protein Renin, Uniprot P00797
DOI: 10.7270/q24q7v5b
title: BindingDB Entry 50032002: A new group of oxime carbamates as reversible inhibitors of fatty acid amide hydrolase.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), 5-Hydroxytryptamine receptor 6 (5-HT6), 5-Hydroxytryptamine receptor 7 (5-HT7), 5-hydroxytryptamine receptor 1A, Adenosine receptor A1, Adenosine receptor A2a, Adenosine receptor A3, Anandamide amidohydrolase, Angiotensin II receptor, BDKRB2, Beta-1 adrenergic receptor, Beta-2 adrenergic receptor and beta-3 adrenergic receptor, C-C chemokine receptor type 1, Cannabinoid receptor, Cannabinoid receptor 1 (CB1R), Cholecystokinin receptor, Dopamine D1 and D2 receptor, Dopamine receptor D2L/neurotensin receptor NTS1, EDNRA, Galanin receptor 2, Histamine H1 receptor, Histamine H2 Receptor, Interleukin-8 receptors, CXCR2, Melanocortin receptor 4, Melatonin receptor, Monoacylglycerol lipase ABHD12, Mu-type opioid receptor, Muscarinic acetylcholine receptor, Muscarinic acetylcholine receptor M1, Muscarinic acetylcholine receptor M2, Neurokinin 2 receptor, Neurokinin 3 receptor, Neuropeptide Y receptor type 1, Neuropeptide Y receptor type 2, Nociceptin receptor, Opioid receptor, Prostanoid TP receptor, Serotonin (5-HT) receptor, Serotonin 1B/1D receptor, Serotonin 3 (5-HT3) receptor, Serotonin and norepinephrine transporters (SERT/NET), Small conductance calcium-activated potassium channel, Sodium-dependent dopamine transporter, Transient receptor potential cation channel subfamily V member 1, and Vasopressin V1a receptor (V1a), Uniprot O08914, O43603, P07550, P08172, P08588, P08908, P0DMS8, P11229, P14416, P20309, P21452, P21728, P21731, P25021, P25025, P25101, P25929, P28223, P28564, P29274, P29371, P30411, P30542, P30556, P30989, P31645, P32238, P32245, P32246, P34969, P34975, P35367, P35372, P37288, P41146, P46098, P47746, P47898, P47936, P48039, P49146, P50406, P70606, Q01959, Q704Y3, and Q99LR1
DOI: 10.7270/q28915sz
title: BindingDB Entry 50029008: TBA

description: Small molecule binding data for protein Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor, Uniprot P61169
DOI: 10.7270/q28g8ks9
title: BindingDB Entry 50031019: Exploring SAR features in diverse library of 4-cyanomethyl-pyrazole-3-carboxamides suitable for further elaborations as CB1 antagonists.

description: Small molecule binding data for protein Cannabinoid receptor 1, Uniprot P21554
DOI: 10.7270/q28g8kv6
title: BindingDB Entry 50032000: Rational design of a novel peripherally-restricted, orally active CB(1) cannabinoid antagonist containing a 2,3-diarylpyrrole motif.

description: Small molecule binding data for protein Cannabinoid receptor and Cannabinoid receptor 1, Uniprot P20272 and P21554
DOI: 10.7270/q2bc3zjd
title: BindingDB Entry 50030043: TBA

description: Small molecule binding data for protein Bradykinin B1 receptor and Bradykinin B2 receptor, Uniprot O70526, P30411, and P97583
DOI: 10.7270/q2d79bh1
title: BindingDB Entry 50031018: Pyrazole derived from (+)-3-carene; a novel potent, selective scaffold for sphingosine-1-phosphate (S1P(1)) receptor agonists.

description: Small molecule binding data for protein Sphingosine 1-Phosphate Receptor 4, Sphingosine 1-Phosphate Receptor 5, Sphingosine 1-phosphate receptor, and Sphingosine 1-phosphate receptor 3, Uniprot O95977, P21453, Q99500, and Q9H228
DOI: 10.7270/q2d79bkx
title: BindingDB Entry 50031999: NF-kappaB inducing kinase (NIK) inhibitors: identification of new scaffolds using virtual screening.

description: Small molecule binding data for protein NF-kappa-beta-inducing kinase (NF-kB), Uniprot Q99558
DOI: 10.7270/q2g44q84
title: BindingDB Entry 50030040: TBA

description: Small molecule binding data for protein Cathepsin D and Human immunodeficiency virus type 1 protease, Uniprot P07339
DOI: 10.7270/q2gt5n4s
title: BindingDB Entry 50029027: TBA

description: Small molecule binding data for protein Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor and NMDA receptor subunit 2C (GluN2C), Uniprot P15823, P23944, P43140, and Q00961
DOI: 10.7270/q2h1324c
title: BindingDB Entry 50031027: Macrocyclic BACE-1 inhibitors acutely reduce Abeta in brain after po application.

description: Small molecule binding data for protein Beta-secretase 1, Cathepsin D, and Cathepsin E, Uniprot P07339, P14091, and P56817
DOI: 10.7270/q2ht2p7q
title: BindingDB Entry 50029006: TBA

description: Small molecule binding data for protein Leukocyte elastase, Uniprot P08246
DOI: 10.7270/q2j1038r
title: BindingDB Entry 50031016: Oxygenated analogues of UK-396082 as inhibitors of activated thrombin activatable fibrinolysis inhibitor.

description: Small molecule binding data for protein Thrombin-activable fibrinolysis inhibitor (TAFIa) and Thrombin-activatable fibrinolysis (TAFI), Uniprot P15086 and Q96IY4
DOI: 10.7270/q2j103bn
title: BindingDB Entry 50031998: Piperidinyl-nicotinamides as potent and selective somatostatin receptor subtype 5 antagonists.

description: Small molecule binding data for protein Somatostatin receptor, Uniprot P35346
DOI: 10.7270/q2kw5g10
title: BindingDB Entry 50030038: TBA

description: Small molecule binding data for protein Acetylcholinesterase and Acetylcholinesterase and butyrylcholinesterase (AChE and BChE), Uniprot P22303 and P37136
DOI: 10.7270/q2mk6ctn
title: BindingDB Entry 50029025: TBA

description: Small molecule binding data for protein Glutamate-NMDA, Uniprot P35439
DOI: 10.7270/q2ns0v34
title: BindingDB Entry 50031997: T-type calcium channel blockers: spiro-piperidine azetidines and azetidinones-optimization, design and synthesis.

description: Small molecule binding data for protein Calcium channel (Type T,L), Uniprot O95180
DOI: 10.7270/q2qn66sr
title: BindingDB Entry 50030037: TBA

description: Small molecule binding data for protein Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor, Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor, Serotonin (5-HT) receptor, and Serotonin receptor 2a and 2c (5HT2A and 5HT2C), Uniprot P08909, P14842, P15823, P19327, P23944, P43140, and P61169
DOI: 10.7270/q2rb74hx
title: BindingDB Entry 50029023: TBA

description: Small molecule binding data for protein Ionotropic glutamate receptor NMDA 1/2D, Uniprot P35439
DOI: 10.7270/q2rj4jkq
title: BindingDB Entry 50031025: The comparative antimalarial properties of weak base and neutral synthetic ozonides.

description: Small molecule binding data for protein Cytochrome P450 2C19, Cytochrome P450 2C9, and Cytochrome P450 3A, Uniprot P08684, P11712, and P33261
DOI: 10.7270/q2rj4jp2
title: BindingDB Entry 50032005: 2-Phenyl-9H-purine-6-carbonitrile derivatives as selective cathepsin S inhibitors.

description: Small molecule binding data for protein Cathepsin (B and K), Cathepsin K, Cathepsin L1, and Cathepsin S, Uniprot P07711, P07858, P25774, and P43235
DOI: 10.7270/q2vd6zgn
title: BindingDB Entry 50030033: TBA

description: Small molecule binding data for protein Neurokinin 1 receptor, Neurokinin 2 receptor, and Neurokinin 3 receptor, Uniprot P16177, P21452, P25103, and P79218
DOI: 10.7270/q2w095vc
title: BindingDB Entry 50029011: TBA

description: Small molecule binding data for protein Thromboxane A2 Synthase (P450 TxA2), Uniprot P24557
DOI: 10.7270/q2w66kv8
title: BindingDB Entry 50031024: Quinoline-3-carboxamide containing sulfones as liver X receptor (LXR) agonists with binding selectivity for LXRbeta and low blood-brain penetration.

description: Small molecule binding data for protein Liver X receptor (LXR alpha AND LXR beta), Uniprot P55055 and Q13133
DOI: 10.7270/q2w959ds
title: BindingDB Entry 50032004: Design, synthesis, and structure-activity relationships of pyrazole derivatives as potential FabH inhibitors.

description: Small molecule binding data for protein Beta-ketoacyl-ACP synthase III (FabH), Uniprot C3TDZ2