cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2zc85c4
title: BindingDB Entry 50001204: Discovery of novel 2-[(4-hydroxy-6-oxo-2,3-dihydro-1H-pyridine-5-carbonyl)amino]acetic acid derivatives as HIF prolyl hydroxylase inhibitors for treatment of renal anemia.

description: Small molecule binding data for protein Egl nine homolog 1 and Hypoxia-inducible factor (HIF-PH2), Uniprot P59722, Q9GZT9, and R4SCQ0
DOI: 10.7270/q2pz5cbd
title: BindingDB Entry 50001206: Novel amidrazone derivatives: Design, synthesis and activity evaluation.

description: Small molecule binding data for protein Acid-sensing ion channel 1, Uniprot P55926
DOI: 10.7270/q2tq641p
title: BindingDB Entry 50001205: Novel naphthyloxy derivatives - Potent histamine H

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 2A, 5-hydroxytryptamine receptor 6, 5-hydroxytryptamine receptor 7, Cytochrome P450 3A, Histamine H3 receptor, and Histamine receptor (H3 and H4), Uniprot P08684, P28223, P34969, P50406, P58406, Q540P3, Q6GRK0, Q9QYN8, and Q9Y5N1
DOI: 10.7270/q2k64mkj
title: BindingDB Entry 50001207: Discovery of dimethyl pent-4-ynoic acid derivatives, as potent and orally bioavailable DGAT1 inhibitors that suppress body weight in diet-induced mouse obesity model.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A, Diacylglycerol O-acyltransferase 1, Diacylglycerol O-acyltransferase 1 (DGAT1), and Diacylglycerol O-acyltransferase 2, Uniprot C1ID52, O75907, P05177, P08684, P10635, P11712, P33261, Q54AA6, Q6GRK0, Q96PD7, Q9Z2A7, and S5RV20
DOI: 10.7270/q29p344w
title: BindingDB Entry 50001209: Structure-activity relationship investigation of Phe-Arg mimetic region of human glutaminyl cyclase inhibitors.

description: Small molecule binding data for protein Glutaminyl-peptide cyclotransferase, Uniprot Q16769
DOI: 10.7270/q2ff3vvt
title: BindingDB Entry 50001208: Design, Synthesis, and Testing of Potent, Selective Hepsin Inhibitors via Application of an Automated Closed-Loop Optimization Platform.

description: Small molecule binding data for protein Hepsin and Urokinase-type plasminogen activator/surface receptor, Uniprot A0A024QZM9, A0A140VJK9, P00749, and P05981
DOI: 10.7270/q25x2cfm
title: BindingDB Entry 50001210: Design, synthesis and evaluation of substituted piperidine based KCNQ openers as novel antiepileptic agents.

description: Small molecule binding data for protein KCNQ (Kv7) potassium channel, Uniprot O43526
DOI: 10.7270/q2251mq6
title: BindingDB Entry 50001211: Structure-activity relationship of clovamide and its related compounds for the inhibition of amyloidβ aggregation.

description: Small molecule binding data for protein Beta amyloid A4 protein, Uniprot A0A140VJC8 and P05067
DOI: 10.7270/q2xg9tm7
title: BindingDB Entry 50001212: Design, synthesis and cardiovascular evaluation of some aminoisopropanoloxy derivatives of xanthone.

description: Small molecule binding data for protein Adrenergic receptor beta and Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor, Uniprot P15823, P18090, P23944, and P43140
DOI: 10.7270/q2sq92ww
title: BindingDB Entry 50001213: 1,2,4-Triazolsulfone: A novel isosteric replacement of acylsulfonamides in the context of Na

description: Small molecule binding data for protein Sodium channel protein type 5 subunit alpha and Sodium channel protein type 9 subunit alpha, Uniprot Q14524 and Q15858
DOI: 10.7270/q2nz8b44
title: BindingDB Entry 50001214: 2-Methylacrylamide as a bioisoster of thiourea group for 1,3-dibenzylthioureido TRPV1 receptor antagonists.

description: Small molecule binding data for protein Vanilloid receptor, Uniprot O35433
DOI: 10.7270/q2df6tp0
title: BindingDB Entry 50001216: Discovery of evocalcet, a next-generation calcium-sensing receptor agonist for the treatment of hyperparathyroidism.

description: Small molecule binding data for protein CYP3A-M, Calcium sensing receptor, Cytochrome P450 1A, Cytochrome P450 2A6, Cytochrome P450 2B6, Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 2E1, and Extracellular calcium-sensing receptor, Uniprot C1ID52, P05177, P05181, P08684, P10632, P10635, P11509, P11712, P20813, P20815, P33261, P41180, P48442, Q6GRK0, and S5RV20
DOI: 10.7270/q2j67kdq
title: BindingDB Entry 50001215: Discovery of Potent and Selective Periphery-Restricted Quinazoline Inhibitors of the Cyclic Nucleotide Phosphodiesterase PDE1.

description: Small molecule binding data for protein 3',5'-cyclic phosphodiesterase, Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1A, Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1B, Calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase 1C, Homo sapiens phosphodiesterase 2A (PDE2A), Phosphodiesterase 11A, Phosphodiesterase 6, Phosphodiesterase 8, cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, cAMP-specific 3',5'-cyclic phosphodiesterase 4D, and cAMP-specific 3',5'-cyclic phosphodiesterase 7B, Uniprot A0A024RB59, A0A0S2Z4T6, A0A140VJR0, A0A1B1UZR0, O00408, O76074, O76083, O95263, P11541, P54750, Q01064, Q08499, Q14123, Q14432, Q9HCR9, Q9NP56, and Q9Y233
DOI: 10.7270/q28p631z
title: BindingDB Entry 50001217: Design, synthesis and evaluation of vilazodone-tacrine hybrids as multitarget-directed ligands against depression with cognitive impairment.

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 1A, Acetylcholinesterase and butyrylcholinesterase (AChE and BChE), and Sodium-dependent serotonin transporter, Uniprot P08908, P31645, P37136, Q5ZGX3, and Q9JKC1
DOI: 10.7270/q24x5b97
title: BindingDB Entry 50001218: Discovery of tetrahydroindazoles as a novel class of potent and in vivo efficacious gamma secretase modulators.

description: Small molecule binding data for protein Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A, 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, C1ID52, P08684, P10632, P10635, P11712, P33261, P49768, P49810, Q6GRK0, Q8WW43, Q92542, Q96BI3, Q9NZ42, and S5RV20
DOI: 10.7270/q218390j
title: BindingDB Entry 50001219: Discovery of novel anti-tuberculosis agents with pyrrolo[1,2-a]quinoxaline-based scaffold.

description: Small molecule binding data for protein Enoyl-ACP Reductase (InhA), Uniprot P9WGR1
DOI: 10.7270/q2wh2shv
title: BindingDB Entry 50001220: Discovery of (E)-1-amino-4-phenylbut-3-en-2-ol derivatives as novel neuraminidase inhibitors.

description: Small molecule binding data for protein Neuraminidase
DOI: 10.7270/q2rr21r2
title: BindingDB Entry 50001221: Design, synthesis and evaluation of potent and selective inhibitors of mono-(ADP-ribosyl)transferases PARP10 and PARP14.

description: Small molecule binding data for protein Poly [ADP-ribose] polymerase 1, Poly [ADP-ribose] polymerase 10, Poly [ADP-ribose] polymerase 14, Poly [ADP-ribose] polymerase 15, Poly [ADP-ribose] polymerase 2, Poly [ADP-ribose] polymerase tankyrase-1, and Poly [ADP-ribose] polymerase tankyrase-2, Uniprot A0A024R3T8, O95271, P09874, Q460N3, Q460N5, Q53GL7, Q9H2K2, and Q9UGN5
DOI: 10.7270/q2n01912
title: BindingDB Entry 50001222: Investigations on small molecule inhibitors targeting the histone H3K4 tri-methyllysine binding PHD-finger of JmjC histone demethylases.

description: Small molecule binding data for protein Lysine-specific demethylase 5A/5B, Lysine-specific demethylase 7A/7B, and Lysine-specific demethylase PHF2, Uniprot O75151, P29375, Q6ZMT4, and Q9UPP1
DOI: 10.7270/q2cf9smh
title: BindingDB Entry 50001229: Discovery of a bicyclo[4.3.0]nonane derivative DS88790512 as a potent, selective, and orally bioavailable blocker of transient receptor potential canonical 6 (TRPC6).

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GLS2, Short transient receptor potential channel 6, and Sodium channel protein type 5 subunit alpha, Uniprot P40989, Q14524, Q61143, and Q9Y210
DOI: 10.7270/q2h70j9b
title: BindingDB Entry 50001223: Straightforward hit identification approach in fragment-based discovery of bromodomain-containing protein 4 (BRD4) inhibitors.

description: Small molecule binding data for protein Bromodomain-containing protein 4, Uniprot O60885
DOI: 10.7270/q27s7r82
title: BindingDB Entry 50001230: An SAR study of hydroxy-trifluoromethylpyrazolines as inhibitors of Orai1-mediated store operated Ca

description: Small molecule binding data for protein Calcium release-activated calcium channel, Uniprot A0A024RBT3 and Q96D31
DOI: 10.7270/q24170kg
title: BindingDB Entry 50001231: Brain penetrant kinase inhibitors: Learning from kinase neuroscience discovery.

description: Small molecule binding data for protein Bcr-Abl, Uniprot A0A024R8E2, P00519, and P11274
DOI: 10.7270/q20867vr
title: BindingDB Entry 50001232: Design and synthesis of 2,6-disubstituted-8-amino imidazo[1,2a]pyridines, a promising privileged structure.

description: Small molecule binding data for protein Adenosine receptor A2a, Uniprot P29274 and X5DNB4
DOI: 10.7270/q2vh5rcg
title: BindingDB Entry 50001234: Discovery of benzimidazole derivatives as orally active renin inhibitors: Optimization of 3,5-disubstituted piperidine to improve pharmacokinetic profile.

description: Small molecule binding data for protein Renin, Uniprot P00797, P08424, and Q6DLW5
DOI: 10.7270/q2qr50n4
title: BindingDB Entry 50001237: The discovery of VU0486846: steep SAR from a series of M

description: Small molecule binding data for protein Muscarinic acetylcholine receptor M1 and M3 and Muscarinic receptor M1 and M2, Uniprot P08482, P11229, and Q53XZ3
DOI: 10.7270/q2g73h89
title: BindingDB Entry 50001242: N-aryl-piperidine-4-carboxamides as a novel class of potent inhibitors of MALT1 proteolytic activity.

description: Small molecule binding data for protein MALT lymphoma-associated translocation (MALT1), Uniprot Q9UDY8
DOI: 10.7270/q2m047z5
title: BindingDB Entry 50001239: Design, synthesis and biological evaluation of novel pyrimidinedione derivatives as DPP-4 inhibitors.

description: Small molecule binding data for protein Dipeptidyl peptidase 4, Uniprot P27487
DOI: 10.7270/q26t0q5p
title: BindingDB Entry 50001245: Discovery of amino-1,4-oxazines as potent BACE-1 inhibitors.

description: Small molecule binding data for protein Beta-secretase 1, Uniprot A0A024R3D7 and P56817
DOI: 10.7270/q2bk1fvj
title: BindingDB Entry 50001244: The discovery and preclinical evaluation of BMS-707035, a potent HIV-1 integrase strand transfer inhibitor.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A, Integrase, and Nuclear receptor subfamily 1 group I member 2, Uniprot C1ID52, F2WR39,F2WR52,Q76353, O75469, P05177, P08684, P10635, P11712, P33261, Q6GRK0, and S5RV20
DOI: 10.7270/q2319zd8
title: BindingDB Entry 50001246: Discovery of novel 20S proteasome inhibitors by rational topology-based scaffold hopping of bortezomib.

description: Small molecule binding data for protein Proteasome subunit beta type-1/beta type-5, Uniprot P28074
DOI: 10.7270/q2z89fxz
title: BindingDB Entry 50001248: BET bromodomain ligands: Probing the WPF shelf to improve BRD4 bromodomain affinity and metabolic stability.

description: Small molecule binding data for protein Bromodomain-containing protein 4 and CREB-binding protein, Uniprot O60885 and Q92793
DOI: 10.7270/q2pr7zgx
title: BindingDB Entry 50001250: Discovery of novel N-hydroxy-2-arylisoindoline-4-carboxamides as potent and selective inhibitors of HDAC11.

description: Small molecule binding data for protein Histone deacetylase 1, Histone deacetylase 10, Histone deacetylase 11, Histone deacetylase 2, Histone deacetylase 3, Histone deacetylase 4, Histone deacetylase 5, Histone deacetylase 6, Histone deacetylase 7, Histone deacetylase 8, and Histone deacetylase 9, Uniprot A0A024QZ26, O15379, P56524, Q13547, Q6IT96, Q8WUI4, Q92769, Q969S8, Q96DB2, Q9BY41, Q9UBN7, Q9UKV0, and Q9UQL6
DOI: 10.7270/q2th8q6n
title: BindingDB Entry 50001249: Synthesis and antiviral evaluation of novel peptidomimetics as norovirus protease inhibitors.

description: Small molecule binding data for protein Nonstructural polyprotein and Protease, Uniprot G1FEK8 and I1U3K2
DOI: 10.7270/q2fb55fw
title: BindingDB Entry 50001255: Design and synthesis of a series of bioavailable fatty acid synthase (FASN) KR domain inhibitors for cancer therapy.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C8, Cytochrome P450 2C9, Cytochrome P450 2D6, Cytochrome P450 3A, and Fatty acid synthase, Uniprot C1ID52, P05177, P08684, P10632, P10635, P11712, P33261, P49327, Q6GRK0, and S5RV20
DOI: 10.7270/q29k4drm
title: BindingDB Entry 50001256: Potent and Highly Selective Inhibitors of the Proteasome Trypsin-like Site by Incorporation of Basic Side Chain Containing Amino Acid Derived Sulfonyl Fluorides.

description: Small molecule binding data for protein 26S proteosome, Proteasome Macropain subunit, Proteasome subunit beta type-1/beta type-5, and Proteasome subunit beta type-10, Uniprot A0A140VJS6, P28062, P28074, P40306, P49721, and X5CMJ9
DOI: 10.7270/q2k076sb
title: BindingDB Entry 50001253: Synthesis and profiling of benzylmorpholine 1,2,4,5-tetraoxane analogue N205: Towards tetraoxane scaffolds with potential for single dose cure of malaria.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6, and Cytochrome P450 3A, Uniprot C1ID52, P05177, P08684, P10635, P11712, P33261, Q6GRK0, and S5RV20
DOI: 10.7270/q2222x8f
title: BindingDB Entry 50001260: Adamantyl thioureas as soluble epoxide hydrolase inhibitors.

description: Small molecule binding data for protein EBifunctional epoxide hydrolase 2, Epoxide hydratase, and Epoxide hydrolase 2, Uniprot P34913, P34914, and P80299
DOI: 10.7270/q25t3p0v
title: BindingDB Entry 50001257: Boronic acid inhibitors of the class Aβ-lactamase KPC-2.

description: Small molecule binding data for protein Beta-lactamase AmpC, Uniprot P00811
DOI: 10.7270/q2x92ds4
title: BindingDB Entry 50001261: Chiral analogues of (+)-cyclazosin as potentα

description: Small molecule binding data for protein Adrenergic receptor alpha, Alpha adrenergic receptor (1a and 1d), and Alpha-1A adrenergic receptor, Uniprot B0ZBE0, P25100, P35348, and P35368
DOI: 10.7270/q2j38w3r
title: BindingDB Entry 50001264: Design, synthesis and molecular modeling of new 4-phenylcoumarin derivatives as tubulin polymerization inhibitors targeting MCF-7 breast cancer cells.

description: Small molecule binding data for protein Tubulin beta chain, Uniprot P07437 and Q5SU16
DOI: 10.7270/q2ns0xd0
title: BindingDB Entry 50001263: Antidiabetic potential of phytochemicals isolated from the stem bark of Myristica fatua Houtt. var. magnifica (Bedd.) Sinclair.

description: Small molecule binding data for protein Pancreatic alpha-amylase and Serum albumin, Uniprot P00690 and P02769
DOI: 10.7270/q2sj1p38
title: BindingDB Entry 50001262: Docking Screens for Dual Inhibitors of Disparate Drug Targets for Parkinson's Disease.

description: Small molecule binding data for protein Adenosine receptor A1, Adenosine receptor A2a, Adenosine receptor A2b, Adenosine receptor A3, Amine oxidase (flavin-containing) A, and Amine oxidase [flavin-containing] B, Uniprot P0DMS8, P21397, P27338, P29274, P29275, P30542, Q53YE7, and X5DNB4
DOI: 10.7270/q28k7cm7
title: BindingDB Entry 50001266: Isoxazole-tethered diarylheptanoid analogs: Discovery of a new drug-like PAR2 antagonist.

description: Small molecule binding data for protein Beta amyloid A4 protein and Proteinase-activated receptor 2, Uniprot A0A140VJC8, P05067, and P55085
DOI: 10.7270/q2db84dv
title: BindingDB Entry 50001265: Development of autotaxin inhibitors: A series of zinc binding triazoles.

description: Small molecule binding data for protein Ectonucleotide pyrophosphatase/phosphodiesterase family member 2 and Potassium voltage-gated channel subfamily H member 2, Uniprot A0A090N8Q0, Q12809, and Q13822
DOI: 10.7270/q24t6mwh
title: BindingDB Entry 50001267: Structure-activity relationship of uridine-based nucleoside phosphoramidate prodrugs for inhibition of dengue virus RNA-dependent RNA polymerase.

description: Small molecule binding data for protein Nonstructural protein 5, Uniprot V5TFZ2
DOI: 10.7270/q2125w5h
title: BindingDB Entry 50001268: Drug efficacy of novel 3-O-methoxy-4-halo disubstituted 5,7-dimethoxy chromans; evaluated via DNA gyrase inhibition, bacterial cell wall lesion and antibacterial prospective.

description: Small molecule binding data for protein DNA Gyrase, Uniprot A0A068A4Y4, P0A0K8, and P20831
DOI: 10.7270/q2rj4n0b
title: BindingDB Entry 50001270: Design and synthesis of functionalized piperazin-1yl-(E)-stilbenes as inhibitors of 17α-hydroxylase-C17,20-lyase (Cyp17).

description: Small molecule binding data for protein Cytochrome P450 17A1, Cytochrome P450 19A1, and Cytochrome P450 3A, Uniprot A0A024R5S8, P05093, P08684, P11511, Q1HB44, and Q6GRK0
DOI: 10.7270/q2w95cp6
title: BindingDB Entry 50001269: Pyrrolinone derivatives as a new class of P2X3 receptor antagonists. Part 1: Initial structure-activity relationship studies of a hit from a high throughput screening.

description: Small molecule binding data for protein P2X purinoceptor 1, P2X purinoceptor 4, P2X purinoceptor 7, and P2X2/3, Uniprot P51575, P56373, Q99571, Q99572, and Q9UBL9
DOI: 10.7270/q2h41tzh
title: BindingDB Entry 50001272: Discovery and synthesis of 6,7,8,9-tetrahydro-5H-pyrido[4,3-c]azepin-5-one-based novel chemotype CCR2 antagonists via scaffold hopping strategy.

description: Small molecule binding data for protein C-C chemokine receptor type 2 and CCR5/mu opioid receptor complex, Uniprot P41597, P51681, and Q38L21
DOI: 10.7270/q2cc1364
title: BindingDB Entry 50001273: Design, synthesis and biological evaluation of phosphopeptides as Polo-like kinase 1 Polo-box domain inhibitors.

description: Small molecule binding data for protein Serine/threonine-protein kinase PLK1, Serine/threonine-protein kinase PLK2, and Serine/threonine-protein kinase PLK3, Uniprot A0A024QZV1, P53350, Q9H4B4, and Q9NYY3
DOI: 10.7270/q2mw2kng
title: BindingDB Entry 50001271: Elucidating the inhibition of peptidoglycan biosynthesis in Staphylococcus aureus by albocycline, a macrolactone isolated from Streptomyces maizeus.

description: Small molecule binding data for protein UDP-N-acetylglucosamine 1-carboxyvinyltransferase 1, Uniprot P84058
DOI: 10.7270/q2028v14
title: BindingDB Entry 50001280: New TRAP1 and Hsp90 chaperone inhibitors with cationic components: Preliminary studies on mitochondrial targeting.

description: Small molecule binding data for protein Heat shock protein 75 kDa, mitochondrial and Heat shock protein HSP 90-alpha, Uniprot A0A140VJY2, K9JA46, P07900, and Q12931
DOI: 10.7270/q27m0bfz
title: BindingDB Entry 50001274: Discovery of Highly Isoform Selective Orally Bioavailable Phosphoinositide 3-Kinase (PI3K)-γ Inhibitors.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GLS2, Dual specificity protein kinase CLK1/CLK4, Phosphatidylinositol 3-kinase catalytic subunit type 3, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform/gamma isoform, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform, Phosphatidylinositol 4-phosphate 3-kinase C2 domain-containing subunit alpha, Phosphatidylinositol 4-phosphate 3-kinase C2 domain-containing subunit beta, Phosphatidylinositol-4-phosphate 3-kinase C2 domain-containing subunit gamma, Phosphoinositide 3-Kinase (PI3K), delta, Purinergic receptor P2Y1, Serine/threonine-protein kinase 17A, p110α/p85α, and p110β/p85α, Uniprot A0A024R720, A0A2K8FKV1, A0A2X0SFG1, A2RUF7, L7RRS0, O00329, O00443, O00750, O75747, P27986, P40989, P42336, P42338, P47900, P48736, Q8NEB9, Q9HAZ1, Q9JHG7, and Q9UEE5
DOI: 10.7270/q23t9kqp
title: BindingDB Entry 50001279: Synthesis and evaluation of 2-substituted 4(3H)-quinazolinone thioether derivatives as monoamine oxidase inhibitors.

description: Small molecule binding data for protein Amine oxidase (flavin-containing) A and Amine oxidase [flavin-containing] B, Uniprot P21397, P27338, and Q53YE7
DOI: 10.7270/q2v98bk8
title: BindingDB Entry 50001281: Design and Synthesis of a Novel Series of Orally Bioavailable, CNS-Penetrant, Isoform Selective Phosphoinositide 3-Kinaseγ (PI3Kγ) Inhibitors with Potential for the Treatment of Multiple Sclerosis (MS).

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GLS2, DNA-dependent protein kinase, Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform/gamma isoform, and Phosphatidylinositol-4,5-bisphosphate 3-kinase, catalytic subunit gamma, Uniprot A0A024R720, D3ZFJ0, P40989, P48736, and P78527
DOI: 10.7270/q2qn6988
title: BindingDB Entry 50001282: Development, Optimization, and Structure-Activity Relationships of Covalent-Reversible JAK3 Inhibitors Based on a Tricyclic Imidazo[5,4- d]pyrrolo[2,3- b]pyridine Scaffold.

description: Small molecule binding data for protein Non-receptor tyrosine-protein kinase TYK2, Tyrosine-protein kinase BTK, Tyrosine-protein kinase JAK1, Tyrosine-protein kinase JAK2, and Tyrosine-protein kinase JAK3, Uniprot A0A024R7E4, A0A024R7M7, O60674, P23458, P29597, P52333, and Q06187
DOI: 10.7270/q2kw5jjj
title: BindingDB Entry 50001283: Chemical space screening around Phe

description: Small molecule binding data for protein Delta-type opioid receptor, Mu-type opioid receptor, Nociceptin/mu opioid receptor, and Opioid receptors; mu & delta, Uniprot A2AD37, P32300, P33533, P33535, P42866, and P97266
DOI: 10.7270/q2g44ssp
title: BindingDB Entry 50001284: Benzofuro[3,2-d]pyrimidines inspired from cercosporamide CaPkc1 inhibitor: Synthesis and evaluation of fluconazole susceptibility restoration.

description: Small molecule binding data for protein Aurora kinase B, Casein kinase 1, delta tv1, Casein kinase I isoform epsilon, Cyclin-Dependent Kinase 2 (CDK2), Cyclin-Dependent Kinase 5 (CDK5), Cyclin-Dependent Kinase 9 (CDK9), Dual specificity protein kinase CLK1, Dual-specificity tyrosine-(Y)-phosphorylation regulated kinase 1A, Glycogen synthase kinase 3 alpha, Glycogen synthase kinase-3, PKC alpha and beta-2, Serine/threonine-protein kinase haspin, and Serine/threonine-protein kinase pim-1, Uniprot A0A024R880, A0A024RB77, A0A024RD25, A0A090N7W4, B2LUN4, I6LNT8, L7RSM7, M3VH47,A0A4X1U4M7, O60563, P05771, P11309, P17252, P20248, P22518, P24941, P50750, Q00535, Q15078, Q63470, Q8TF76, and Q96GD4
DOI: 10.7270/q2bc4219
title: BindingDB Entry 50001285: Pyrroloquinoline scaffold-based 5-HT

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 6, Uniprot P50406
DOI: 10.7270/q26m399k
title: BindingDB Entry 50001286: Design, synthesis and biological evaluation of pyrimidine derivatives as novel CDK2 inhibitors that induce apoptosis and cell cycle arrest in breast cancer cells.

description: Small molecule binding data for protein CDK-activating kinase assembly factor MAT1/Cyclin H/Cyclin-dependent kinase 7, CDK2/CycE, CDK6/G1/S-specific cyclin D3, Cyclin-Dependent Kinase 4 (CDK4), Cyclin-T1/Cyclin-dependent-like kinase 5, Cyclin-dependent kinase 1, Cyclin-dependent kinase 2, and Cyclin-dependent kinase 9, Uniprot A0A024R688, A0A024R880, A0A024RB77, A0A024RBB6, A0A090N7W4, A0A0S2Z3F9, P06493, P11802, P24385, P24864, P24941, P30281, P50613, P50750, P51946, P51948, Q00534, Q00535, and Q6FI00
DOI: 10.7270/q22v2jkv
title: BindingDB Entry 50001287: Rational design of bis-indolylmethane-oxadiazole hybrids as inhibitors of thymidine phosphorylase.

description: Small molecule binding data for protein Thymidine Phosphorylase (TP) and Thymidine phosphorylase, Uniprot E5KRG5, P07650, and P19971