cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2zk5km5
title: BindingDB Entry 50005804: Design, synthesis and biological evaluation of 3-benzyloxy-linked pyrimidinylphenylamine derivatives as potent HIV-1 NNRTIs.

description: Small molecule binding data for protein Reverse transcriptase, Uniprot Q9WKE8
DOI: 10.7270/q2tt4twf
title: BindingDB Entry 50005806: 1,3-Dialkyl-substituted tetrahydropyrimido[1,2-f]purine-2,4-diones as multiple target drugs for the potential treatment of neurodegenerative diseases.

description: Small molecule binding data for protein Adenosine receptor, Adenosine receptor A1, Adenosine receptor A2a, Adenosine receptor A2a and A3, Adenosine receptor A3, Adenosine receptors; A2a & A2b, Amine oxidase (flavin-containing) A, and Amine oxidase [flavin-containing] B, Uniprot P0DMS8, P21397, P25099, P27338, P28647, P29274, P29275, P30542, P30543, Q53YE7, and X5DNB4
DOI: 10.7270/q2q2435t
title: BindingDB Entry 50005808: Development of fluorinated CB(2) receptor agonists for PET studies.

description: Small molecule binding data for protein Cannabinoid receptor 1 and Cannabinoid receptor 2, Uniprot A0A024RAH7, P21554, P34972, and S5TLS4
DOI: 10.7270/q2k93bgj
title: BindingDB Entry 50005810: Design and synthesis of silicon-containing tubulin polymerization inhibitors: replacement of the ethylene moiety of combretastatin A-4 with a silicon linker.

description: Small molecule binding data for protein Tubulin beta chain, Uniprot P02554
DOI: 10.7270/q2fj2krt
title: BindingDB Entry 50005811: The 3,7-diazabicyclo[3.3.1]nonane scaffold for subtype selective nicotinic acetylcholine receptor ligands. Part 2: carboxamide derivatives with different spacer motifs.

description: Small molecule binding data for protein Neuronal acetylcholine receptor and Neuronal acetylcholine receptor protein alpha-4/beta-2 subunit, Uniprot P09483, P12390, and Q05941
DOI: 10.7270/q29w0jdc
title: BindingDB Entry 50005812: Chromenylchalcones with inhibitory effects on monoamine oxidase B.

description: Small molecule binding data for protein Amine oxidase [flavin-containing] B, Uniprot P27338
DOI: 10.7270/q2639spd
title: BindingDB Entry 50005814: Recycling antimalarial leads for cancer: Antiproliferative properties of N-cinnamoyl chloroquine analogues.

description: Small molecule binding data for protein Receptor tyrosine-protein kinase erbB-2, Uniprot P04626 and X5DNK3
DOI: 10.7270/q22b91z2
title: BindingDB Entry 50005816: Salen and tetrahydrosalen derivatives act as effective inhibitors of the tumor-associated carbonic anhydrase XII--a new scaffold for designing isoform-selective inhibitors.

description: Small molecule binding data for protein Carbonic anhydrase and Carbonic anhydrases; II & IX, Uniprot A0A0S2Z3D0, O43570, P00915, P00918, Q16790, V9HW21, and V9HWE3
DOI: 10.7270/q2xk8jgs
title: BindingDB Entry 50005819: A prodrug approach toward cancer-related carbonic anhydrase inhibition.

description: Small molecule binding data for protein Carbonic anhydrase and Carbonic anhydrases; II & IX, Uniprot A0A0S2Z3D0, A8K3J4, O43570, P00915, P00918, Q16790, Q9ULX7, V9HW21, and V9HWE3
DOI: 10.7270/q2st7sr2
title: BindingDB Entry 50005820: Design, synthesis, and biological evaluation of 1,2,4-triazole bearing 5-substituted biphenyl-2-sulfonamide derivatives as potential antihypertensive candidates.

description: Small molecule binding data for protein Angiotensin II receptor, Uniprot P30556, P50052, and Q53YY0
DOI: 10.7270/q2p2722w
title: BindingDB Entry 50005822: Radionuclide labeling and evaluation of candidate radioligands for PET imaging of histone deacetylase in the brain.

description: Small molecule binding data for protein Cereblon/Histone deacetylase 1, Uniprot Q13547 and Q6IT96
DOI: 10.7270/q2j969b5
title: BindingDB Entry 50005824: Chlorophenylpiperazine analogues as high affinity dopamine transporter ligands.

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 2A, Dopamine D2 receptor and Serotonin 2a receptor (D2 and 5HT2a), Sigma opioid receptor, Sodium-dependent dopamine transporter, and Sodium-dependent serotonin transporter, Uniprot P14842, P23977, P31652, P61169, and Q9R0C9
DOI: 10.7270/q2dn480q
title: BindingDB Entry 50005825: Synthesis and biological evaluation of nimesulide based new class of triazole derivatives as potential PDE4B inhibitors against cancer cells.

description: Small molecule binding data for protein 3',5'-cyclic phosphodiesterase, Uniprot Q07343 and X5DNX5
DOI: 10.7270/q28w3h80
title: BindingDB Entry 50005826: In vitro cytotoxicity on human ovarian cancer cells by T-type calcium channel blockers.

description: Small molecule binding data for protein Voltage-gated T-type calcium channel, Uniprot O43497
DOI: 10.7270/q2542rjk
title: BindingDB Entry 50005827: Novel glycosylated endomorphin-2 analog produces potent centrally-mediated antinociception in mice after peripheral administration.

description: Small molecule binding data for protein Mu-type opioid receptor and Nociceptin/mu opioid receptor, Uniprot P33535 and P97266
DOI: 10.7270/q21c20t7
title: BindingDB Entry 50005828: Removal of human ether-à-go-go related gene (hERG) K+ channel affinity through rigidity: a case of clofilium analogues.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GLS2, Uniprot P40989
DOI: 10.7270/q2wm1hcd
title: BindingDB Entry 50005830: Fine molecular tuning at position 4 of 2H-chromen-2-one derivatives in the search of potent and selective monoamine oxidase B inhibitors.

description: Small molecule binding data for protein Monoamine oxidase, Uniprot P19643 and P21396
DOI: 10.7270/q2rv0rp4
title: BindingDB Entry 50005831: Discovery of benzo[d]imidazo[5,1-b]thiazole as a new class of phosphodiesterase 10A inhibitors.

description: Small molecule binding data for protein 3',5'-cyclic phosphodiesterase, Uniprot A0A1B1UZR0 and Q9Y233
DOI: 10.7270/q2n58q90
title: BindingDB Entry 50005832: Design and synthesis of 1-(3-(dimethylamino)propyl)-1-(4-fluorophenyl)-1,3-dihydroisobenzofuran-5-carbonitrile (citalopram) analogues as novel probes for the serotonin transporter S1 and S2 binding sites.

description: Small molecule binding data for protein Sodium-dependent serotonin transporter, Uniprot P31645 and P31652
DOI: 10.7270/q2hd7zmq
title: BindingDB Entry 50005833: Design, synthesis and biological evaluation of α-substituted isonipecotic acid benzothiazole analogues as potent bacterial type II topoisomerase inhibitors.

description: Small molecule binding data for protein DNA Gyrase and Topoisomerase IV, Uniprot A0A068A4Y4, P0A0K8, P0C1U9, P20831, and Q2FYS5
DOI: 10.7270/q2cn76wc
title: BindingDB Entry 50005834: Novel piperidinylamino-diarylpyrimidine derivatives with dual structural conformations as potent HIV-1 non-nucleoside reverse transcriptase inhibitors.

description: Small molecule binding data for protein Reverse transcriptase, Uniprot Q9WKE8
DOI: 10.7270/q27w6g52
title: BindingDB Entry 50005835: Sulphonamide 1,4-dithia-7-azaspiro[4,4]nonane derivatives as gelatinase A inhibitors.

description: Small molecule binding data for protein Matrix metalloproteinase 2/9, Uniprot A0A024R6R4 and P08253
DOI: 10.7270/q2445qfn
title: BindingDB Entry 50005836: Further discovery of caffeic acid derivatives as novel influenza neuraminidase inhibitors.

description: Small molecule binding data for protein Neuraminidase
DOI: 10.7270/q20c4zqx
title: BindingDB Entry 50005837: Synthesis, docking and pharmacological evaluation of novel homo- and hetero-bis 3-piperazinylpropylindole derivatives at SERT and 5-HT1A receptor.

description: Small molecule binding data for protein 5-hydroxytryptamine receptor 1A and Sodium-dependent serotonin transporter, Uniprot P08908, P31652, and Q5ZGX3
DOI: 10.7270/q2qz2dw5
title: BindingDB Entry 50005839: Synthesis, antioxidant capacity, and structure-activity relationships of tri-O-methylnorbergenin analogues on tyrosinase inhibition.

description: Small molecule binding data for protein Tyrosinase, Uniprot O42713
DOI: 10.7270/q2vm4g71
title: BindingDB Entry 50005838: The most effective influence of 17-(3-ethoxypropyl) substituent on the binding affinity and the agonistic activity in KNT-127 derivatives, δ opioid receptor agonists.

description: Small molecule binding data for protein Delta-type opioid receptor, Kappa-type opioid receptor, Mu-type opioid receptor, Opioid receptors; mu and delta, and mu/kappa opioid receptor, Uniprot A2AD37, P32300, P35372, P41143, P41144, P41145, and P42866
DOI: 10.7270/q2m61p6m
title: BindingDB Entry 50005840: Identification and optimization of an aminoalcohol-carbazole series with antimalarial properties.

description: Small molecule binding data for protein 1,3-beta-glucan synthase component GLS2, Uniprot P40989
DOI: 10.7270/q2gf0xgw
title: BindingDB Entry 50005841: Design, Synthesis, and Antiviral Evaluation of Chimeric Inhibitors of HIV Reverse Transcriptase.

description: Small molecule binding data for protein Reverse transcriptase, Uniprot Q9WKE8
DOI: 10.7270/q2bp05rj
title: BindingDB Entry 50005842: NAD-based inhibitors with anticancer potential.

description: Small molecule binding data for protein Inosine-5'-monophosphate dehydrogenase (IMPDH) and Lanosterol synthase, Uniprot A0A384N6C2, P12268, and P48449
DOI: 10.7270/q26w9f1p
title: BindingDB Entry 50005844: Design, synthesis and preliminary SAR studies of novel N-arylmethyl substituted piperidine-linked aniline derivatives as potent HIV-1 NNRTIs.

description: Small molecule binding data for protein Reverse transcriptase, Uniprot Q9WKE8
DOI: 10.7270/q2348pbq
title: BindingDB Entry 50005846: Structure-based screening for the discovery of new carbonic anhydrase VII inhibitors.

description: Small molecule binding data for protein Carbonic anhydrase and Carbonic anhydrases; II & IX, Uniprot A0A0S2Z3D0, A8K3J4, P00915, P00918, P43166, Q16790, Q9ULX7, V9HW21, and V9HWE3
DOI: 10.7270/q2zc85vd
title: BindingDB Entry 50005848: Synthesis and preliminary evaluation of a new fluorine-18 labelled triazine derivative for PET imaging of cannabinoid CB2 receptor.

description: Small molecule binding data for protein Cannabinoid receptor 1 and Cannabinoid receptor 2, Uniprot A0A024RAH7, P21554, P34972, and S5TLS4
DOI: 10.7270/q2tq64hz
title: BindingDB Entry 50005850: Synthesis, anti-HIV activity, integrase enzyme inhibition and molecular modeling of catechol, hydroquinone and quinol labdane analogs.

description: Small molecule binding data for protein Integrase, Uniprot F2WR39,F2WR52,Q76353
DOI: 10.7270/q2pz5ctp
title: BindingDB Entry 50005851: Synthesis and anticancer activities of thieno[3,2-d]pyrimidines as novel HDAC inhibitors.

description: Small molecule binding data for protein Histone deacetylase, Uniprot A0A024QZ26, O15379, P56524, Q13547, Q6IT96, Q8WUI4, Q92769, Q969S8, Q96DB2, Q9BY41, Q9UBN7, Q9UKV0, and Q9UQL6
DOI: 10.7270/q2k64n27
title: BindingDB Entry 50005852: Combining the tail and the ring approaches for obtaining potent and isoform-selective carbonic anhydrase inhibitors: solution and X-ray crystallographic studies.

description: Small molecule binding data for protein Carbonic anhydrase, Carbonic anhydrase V, and Carbonic anhydrases; II & IX, Uniprot A0A0S2Z3D0, A8K3J4, O43570, P00915, P00918, P07451, P22748, P23280, P35218, P43166, Q16790, Q8N1Q1, Q9ULX7, V9HW21, V9HWA3, and V9HWE3
DOI: 10.7270/q2ff3wbh
title: BindingDB Entry 50005853: Probing the human estrogen receptor-α binding requirements for phenolic mono- and di-hydroxyl compounds: a combined synthesis, binding and docking study.

description: Small molecule binding data for protein Baculoviral IAP repeat-containing protein 2/Estrogen receptor and Estrogen receptor, Uniprot G4XH65, P03372, Q7LCB3, and Q92731
DOI: 10.7270/q29p34m5
title: BindingDB Entry 50005854: Biphenyl derivatives incorporating urea unit as novel VEGFR-2 inhibitors: design, synthesis and biological evaluation.

description: Small molecule binding data for protein Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2), Uniprot P35968
DOI: 10.7270/q2251n5f
title: BindingDB Entry 50005859: Comparative molecular field analysis of fenoterol derivatives interacting with an agonist-stabilized form of the β₂-adrenergic receptor.

description: Small molecule binding data for protein Adrenergic receptor, Uniprot P07550 and X5DQM5
DOI: 10.7270/q25x2cwf
title: BindingDB Entry 50005857: Synthesis, modification and docking studies of 5-sulfonyl isatin derivatives as SARS-CoV 3C-like protease inhibitors.

description: Small molecule binding data for protein 3C-like proteinase (3CL-PRO), Uniprot A7J8L2 and P0C6X7
DOI: 10.7270/q2xg9v3x
title: BindingDB Entry 50005860: Synthesis and SAR of novel isoxazoles as potent c-jun N-terminal kinase (JNK) inhibitors.

description: Small molecule binding data for protein MAP kinase p38, Mitogen-activated protein kinase 10, and Mitogen-activated protein kinase 8/9, Uniprot A0A024RD04, A0A024RD15, O15264, P45983, P53778, P53779, Q15759, and Q16539
DOI: 10.7270/q2sq93ck
title: BindingDB Entry 50005862: Rationally designed hybrid molecules with appreciable COX-2 inhibitory and anti-nociceptive activities.

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/q2j67kw0
title: BindingDB Entry 50005864: Replacement of amide with bioisosteres led to a new series of potent adenosine A2A receptor antagonists.

description: Small molecule binding data for protein Adenosine receptor A2a, Uniprot P29274 and X5DNB4
DOI: 10.7270/q2nz8bmd
title: BindingDB Entry 50005863: Chemical synthesis and tyrosinase inhibitory activity of rhododendrol glycosides.

description: Small molecule binding data for protein Tyrosinase, Uniprot O42713
DOI: 10.7270/q2df6v5p
title: BindingDB Entry 50005865: Synthesis and biological evaluation of novel 2-amino-3-aroyl-4-neopentyl-5-substituted thiophene derivatives as allosteric enhancers of the A₁ adenosine receptor.

description: Small molecule binding data for protein Adenosine receptor, Uniprot P25099
DOI: 10.7270/q28p63gs
title: BindingDB Entry 50005866: Inhibition of carbonic anhydrases from the extremophilic bacteria Sulfurihydrogenibium yellostonense (SspCA) and S. azorense (SazCA) with a new series of sulfonamides incorporating aroylhydrazone-, [1,2,4]triazolo[3,4-b][1,3,4]thiadiazinyl- or 2-(cyanophenylmethylene)-1,3,4-thiadiazol-3(2H)-yl moiet

description: Small molecule binding data for protein Carbonic anhydrase and Carbonic anhydrases; II & IX, Uniprot P00915, P00918, V9HW21, and V9HWE3
DOI: 10.7270/q24x5br2
title: BindingDB Entry 50005867: A tetradecapeptide somatostatin dicarba-analog: Synthesis, structural impact and biological activity.

description: Small molecule binding data for protein Somatostatin receptor type 1, Somatostatin receptor type 2, Somatostatin receptor type 3, Somatostatin receptor type 4, and Somatostatin receptor type 5, Uniprot P30872, P30874, P31391, P32745, and P35346
DOI: 10.7270/q21839gt
title: BindingDB Entry 50005868: Lactam based 7-amino suberoylamide hydroxamic acids as potent HDAC inhibitors.

description: Small molecule binding data for protein Cereblon/Histone deacetylase 1, Cereblon/Histone deacetylase 2, Cereblon/Histone deacetylase 6, Histone deacetylase 10, Histone deacetylase 11, Histone deacetylase 3/Nuclear receptor corepressor 2, and Histone deacetylase 8, Uniprot A0A024QZ26, O15379, Q13547, Q6IT96, Q92769, Q969S8, Q96DB2, Q9BY41, Q9UBN7, and Q9Y618
DOI: 10.7270/q2wh2szp
title: BindingDB Entry 50005869: Identification of quinones as HER2 inhibitors for the treatment of trastuzumab resistant breast cancer.

description: Small molecule binding data for protein Receptor tyrosine-protein kinase erbB-2, Uniprot P04626 and X5DNK3
DOI: 10.7270/q2rr2269
title: BindingDB Entry 50005870: Discovery of Clinical Candidate GSK1842799 As a Selective S1P1 Receptor Agonist (Prodrug) for Multiple Sclerosis.

description: Small molecule binding data for protein Sphingosine 1-phosphate receptor and Sphingosine 1-phosphate receptor Edg-5/Sphingosine 1-phosphate receptor Edg-3, Uniprot A0A024R7B2, O95136, O95977, P21453, Q99500, and Q9H228
DOI: 10.7270/q2n019gw
title: BindingDB Entry 50005874: Inhibition of CK2: An Attractive Therapeutic Target for Cancer Treatment.

description: Small molecule binding data for protein Casein kinase II subunit alpha', Uniprot P19784
DOI: 10.7270/q2h70jr5
title: BindingDB Entry 50005875: Diphenylpropane Derivatives as Agonist of PPAR Nuclear Receptors.

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor, Uniprot A0A024RCW6, F1D8S4, P37231, Q03181, and Q07869
DOI: 10.7270/q2cf9t19
title: BindingDB Entry 50005876: Structure-activity relationship study of permethyl ningalin B analogues as P-glycoprotein chemosensitizers.

description: Small molecule binding data for protein Multidrug resistance protein 1/Multidrug resistance associated protein 1, Uniprot A4D1D2 and P08183
DOI: 10.7270/q27p92bd
title: BindingDB Entry 50005877: Synthesis, radiosynthesis and first in vitro evaluation of novel PET-tracers for the dopamine transporter: [(11)C]IPCIT and [(18)F]FE@IPCIT.

description: Small molecule binding data for protein Monoamine transporter, Sodium-dependent dopamine transporter, and Sodium-dependent serotonin transporter, Uniprot A0A024R6T9, P23975, P31645, and Q01959
DOI: 10.7270/q2086890
title: BindingDB Entry 50005879: Carbonic anhydrase inhibitors. Synthesis, and molecular structure of novel series N-substituted N'-(2-arylmethylthio-4-chloro-5-methylbenzenesulfonyl)guanidines and their inhibition of human cytosolic isozymes I and II and the transmembrane tumor-associated isozymes IX and XII.

description: Small molecule binding data for protein Carbonic anhydrase and Carbonic anhydrases; II & IX, Uniprot A0A0S2Z3D0, O43570, P00915, P00918, Q16790, V9HW21, and V9HWE3
DOI: 10.7270/q241711q
title: BindingDB Entry 50005878: Controlled-deactivation cannabinergic ligands.

description: Small molecule binding data for protein Cannabinoid receptor and Cannabinoid receptor 2, Uniprot A0A024RAH7, P20272, P34972, and P47936
DOI: 10.7270/q2vh5rt9
title: BindingDB Entry 50005881: Two analogues of fenarimol show curative activity in an experimental model of Chagas disease.

description: Small molecule binding data for protein Cytochrome P450 3A, Uniprot P08684 and Q6GRK0
DOI: 10.7270/q2qr513c
title: BindingDB Entry 50005883: The discovery of potent, orally bioavailable pyrazolo and triazolopyrimidine CXCR2 receptor antagonists.

description: Small molecule binding data for protein Interleukin-8 receptors, CXCR1/CXCR2, Uniprot P25025 and Q53PC4
DOI: 10.7270/q2g73hpp
title: BindingDB Entry 50005885: Identification of novel drug scaffolds for inhibition of SARS-CoV 3-Chymotrypsin-like protease using virtual and high-throughput screenings.

description: Small molecule binding data for protein 3C-like proteinase (3CL-PRO), Uniprot A7J8L2 and P0C6X7
DOI: 10.7270/q2m048dd
title: BindingDB Entry 50005884: Synthesis, biological evaluation and SAR of 3-benzoates of ingenol for treatment of actinic keratosis and non-melanoma skin cancer.

description: Small molecule binding data for protein Protein kinase C, PKC; classical/novel, Uniprot A0A024R328 and Q05655
DOI: 10.7270/q2bg2rzz
title: BindingDB Entry 50005886: Structure-activity relationship study of BACE1 inhibitors possessing a chelidonic or 2,6-pyridinedicarboxylic scaffold at the P(2) position.

description: Small molecule binding data for protein Beta-secretase (BACE), Uniprot A0A024R3D7 and P56817
DOI: 10.7270/q26t0qmh
title: BindingDB Entry 50005887: Synthesis and evaluation of curcumin derivatives toward an inhibitor of beta-site amyloid precursor protein cleaving enzyme 1.

description: Small molecule binding data for protein Beta-secretase (BACE), Uniprot A0A024R3D7 and P56817
DOI: 10.7270/q2319zv3
title: BindingDB Entry 50005888: Synthesis, docking simulation, biological evaluations and 3D-QSAR study of 5-Aryl-6-(4-methylsulfonyl)-3-(metylthio)-1,2,4-triazine as selective cyclooxygenase-2 inhibitors.

description: Small molecule binding data for protein Prostaglandin G/H synthase (cyclooxygenase), Uniprot P05979 and P79208
DOI: 10.7270/q2z89gc6
title: BindingDB Entry 50005889: The marine cyanobacterial metabolite gallinamide A is a potent and selective inhibitor of human cathepsin L.

description: Small molecule binding data for protein Cathepsin (B and K), Cathepsin (H and K), Cathepsin (L and K), and Cathepsin (V and K), Uniprot A0A024R141, A0A024R276, A0A024R374, O60911, P07711, P07858, and P09668
DOI: 10.7270/q2th8qng
title: BindingDB Entry 50005890: Synthesis and evaluation of 4-substituted piperidines and piperazines as balanced affinity μ opioid receptor (MOR) agonist/δ opioid receptor (DOR) antagonist ligands.

description: Small molecule binding data for protein Delta-type opioid receptor, Kappa-type opioid receptor, Mu-type opioid receptor, Nociceptin/mu opioid receptor, and Opioid receptors; mu & delta, Uniprot P33533, P33535, P35372, P41143, and P41145
DOI: 10.7270/q2pr7zxr
title: BindingDB Entry 50005891: Design and synthesis of 2-amino-6-(1H,3H-benzo[de]isochromen-6-yl)-1,3,5-triazines as novel Hsp90 inhibitors.

description: Small molecule binding data for protein Heat shock protein HSP 90-alpha/Hsp90 co-chaperone Cdc37, Uniprot K9JA46 and P07900
DOI: 10.7270/q2k0777k
title: BindingDB Entry 50005892: Enhancing the pharmacodynamic profile of a class of selective COX-2 inhibiting nitric oxide donors.

description: Small molecule binding data for protein Cyclooxygenase, Prostaglandin E synthase/G/H synthase 2, and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P22437, P23219, P35354, Q05769, and Q543T1
DOI: 10.7270/q2f76gj9
title: BindingDB Entry 50005894: Bifunctional thiosialosides inhibit influenza virus.

description: Small molecule binding data for protein Neuraminidase
DOI: 10.7270/q29k4f5d
title: BindingDB Entry 50005898: New natural products as new leads for antibacterial drug discovery.

description: Small molecule binding data for protein Signal peptidase I, Uniprot P00803
DOI: 10.7270/q25t3pfp
title: BindingDB Entry 50005899: Synthesis and biological evaluation of novel oxadiazole derivatives: a new class of thymidine phosphorylase inhibitors as potential anti-tumor agents.

description: Small molecule binding data for protein Thymidine Phosphorylase (TP), Uniprot P07650
DOI: 10.7270/q2222xq8
title: BindingDB Entry 50005901: Inhibition of tyrosinase activity by polyphenol compounds from Flemingia philippinensis roots.

description: Small molecule binding data for protein Tyrosinase, Uniprot O42713
DOI: 10.7270/q2x92f7c
title: BindingDB Entry 50005902: Synthesis, biological evaluation and molecular docking studies of benzyloxyacetohydroxamic acids as LpxC inhibitors.

description: Small molecule binding data for protein UDP-3-O-acyl-GlcNAc deacetylase, Uniprot A0A6D2XJB8 and P0A725
DOI: 10.7270/q2sj1pj3
title: BindingDB Entry 50005904: Original Design of Fluorescent Ligands by Fusing BODIPY and Melatonin Neurohormone.

description: Small molecule binding data for protein Melatonin receptor, Uniprot P48039 and P49286
DOI: 10.7270/q2ns0xvt
title: BindingDB Entry 50005905: FGFR1 Kinase Inhibitors: Close Regioisomers Adopt Divergent Binding Modes and Display Distinct Biophysical Signatures.

description: Small molecule binding data for protein Fibroblast growth factor receptor 1, Uniprot P11362
DOI: 10.7270/q2j10646
title: BindingDB Entry 50005906: Tankyrase inhibitors: potential treatment of hyperproliferative diseases.

description: Small molecule binding data for protein Poly [ADP-ribose] polymerase tankyrase-1 and Poly [ADP-ribose] polymerase tankyrase-2, Uniprot O95271 and Q9H2K2
DOI: 10.7270/q2db84t7
title: BindingDB Entry 50005908: KLIFS: a knowledge-based structural database to navigate kinase-ligand interaction space.

description: Small molecule binding data for protein MAP kinase p38 and p38 MAP kinase alpha/beta, Uniprot A0A024RD04, A0A024RD15, O15264, P53778, Q15759, and Q16539