cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2c828d7
title: BindingDB Entry 50006607: Effects of modifications of residues in position 3 of dynorphin A(1-11)-NH2 on kappa receptor selectivity and potency.

description: Small molecule binding data for protein Delta-type opioid receptor and mu/kappa opioid receptor, Uniprot P32300, P41143, P41144, and P97266
DOI: 10.7270/q2cz36dp
title: BindingDB Entry 50010977: Discovery and characterization of the potent, selective and orally bioavailable MMP inhibitor ABT-770.

description: Small molecule binding data for protein Collagenase, Matrix metalloproteinase-1 (MMP1), Matrix metalloproteinase-7 (MMP7), and Stromelysin-1, Uniprot P03956, P08253, P08254, P09237, and P14780
DOI: 10.7270/q2gq6x13
title: BindingDB Entry 50010993: Expedited discovery of second generation NK-1 antagonists: identification of a nonbasic aryloxy substituent.

description: Small molecule binding data for protein Neurokinin 1 receptor, Uniprot P25103
DOI: 10.7270/q2gt5mch
title: BindingDB Entry 50008774: Inhibition of human telomerase by PNA-cationic peptide conjugates.

description: Small molecule binding data for protein Telomerase reverse transcriptase, Uniprot O14746
DOI: 10.7270/q2h1314z
title: BindingDB Entry 50006603: (S)-(-)-4-[4-[2-(isochroman-1-yl)ethyl]-piperazin-1-yl] benzenesulfonamide, a selective dopamine D4 antagonist.

description: Small molecule binding data for protein DOPAMINE, Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor, Dopamine receptor, Peripheral-Type Benzodiazepine Receptor, Peripheral-type benzodiazepine receptor, and Serotonin (5-HT) receptor, Uniprot P16257, P18901, P19020, P19327, P30729, P50637, P61169, and Q99M32 Q541E3
DOI: 10.7270/q2hq3z5g
title: BindingDB Entry 50010976: Biaryl ether retrohydroxamates as potent, long-lived, orally bioavailable MMP inhibitors.

description: Small molecule binding data for protein Collagenase, Matrix metalloproteinase-1 (MMP1), and Stromelysin-1, Uniprot P03956, P08253, and P08254
DOI: 10.7270/q2hq3z8t
title: BindingDB Entry 50013015: Glycine alpha-ketoamides as HCV NS3 protease inhibitors.

description: Small molecule binding data for protein Genome polyprotein, Uniprot P26664
DOI: 10.7270/q2mg7nw6
title: BindingDB Entry 50013028: N-Phenyl-N-purin-6-yl ureas: the design and synthesis of p38alpha MAP kinase inhibitors.

description: Small molecule binding data for protein Mitogen-activated protein kinase 14, Uniprot Q16539
DOI: 10.7270/q2mk6c2s
title: BindingDB Entry 50008771: Isotope edited NMR studies of glycosidases: design and synthesis of a novel glycosidase inhibitor.

description: Small molecule binding data for protein Lysosomal alpha-glucosidase, Uniprot P10253
DOI: 10.7270/q2ms3rvk
title: BindingDB Entry 50006600: Retinoic acid receptor beta,gamma-selective ligands: synthesis and biological activity of 6-substituted 2-naphthoic acid retinoids.

description: Small molecule binding data for protein Retinoid X receptor gamma/retinoic acid receptor alpha and Retinoid receptor, Uniprot P10276, P10826, and P13631
DOI: 10.7270/q2ng4pws
title: BindingDB Entry 50010972: alpha-Keto heterocycle inhibitors of fatty acid amide hydrolase: carbonyl group modification and alpha-substitution.

description: Small molecule binding data for protein Anandamide amidohydrolase, Uniprot P97612
DOI: 10.7270/q2ng4pzp
title: BindingDB Entry 50013011: Discovery of 4'-[(imidazol-1-yl)methyl]biphenyl-2-sulfonamides as dual endothelin/angiotensin II receptor antagonists.

description: Small molecule binding data for protein EDNRA, Uniprot P25101
DOI: 10.7270/q2r78dkg
title: BindingDB Entry 50013024: Interfacial peptide inhibitors of HIV-1 integrase activity and dimerization.

description: Small molecule binding data for protein Human immunodeficiency virus type 1 integrase
DOI: 10.7270/q2rb73rn
title: BindingDB Entry 50008770: L-770,644: a potent and selective human beta3 adrenergic receptor agonist with improved oral bioavailability.

description: Small molecule binding data for protein Beta-1 adrenergic receptor, Beta-2 adrenergic receptor and beta-3 adrenergic receptor, and Beta-3 adrenergic receptor, Uniprot P07550, P08588, and P13945
DOI: 10.7270/q2rf5t4j
title: BindingDB Entry 50006598: New prolyl endopeptidase inhibitors: in vitro and in vivo activities of azabicyclo[2.2.2]octane, azabicyclo[2.2.1]heptane, and perhydroindole derivatives.

description: Small molecule binding data for protein Endopeptidase prolyl oligopeptidase (PREP) and Prolyl endopeptidase, Uniprot O70196, P48147, and Q9XTA2
DOI: 10.7270/q2s75fmh
title: BindingDB Entry 50010971: Aromatic inhibitors of dehydroquinate synthase: synthesis, evaluation and implications for gallic acid biosynthesis.

description: Small molecule binding data for protein 3-dehydroquinate synthase, Uniprot P07639
DOI: 10.7270/q2v69hp1
title: BindingDB Entry 50006616: Synthesis of 3 beta-aryl-8-azabicyclo[3.2.1]octanes with high binding affinities and selectivities for the serotonin transporter site.

description: Small molecule binding data for protein Dopamine Transporter (DAT), Norepinephrine Monoamine transporters, and Sodium-dependent serotonin transporter, Uniprot P23977 and P31652
DOI: 10.7270/q2w09579
title: BindingDB Entry 50010990: Novel heteroaryl replacements of aromatic 3-tetrafluoroethoxy substituents in trifluoro-3-(tertiaryamino)-2-propanols as potent inhibitors of cholesteryl ester transfer protein.

description: Small molecule binding data for protein Cholesteryl ester transfer protein, Uniprot P11597
DOI: 10.7270/q2w09596
title: BindingDB Entry 50013022: Benzamide derivatives as blockers of Kv1.3 ion channel.

description: Small molecule binding data for protein Voltage-gated potassium channel, Uniprot P22001
DOI: 10.7270/q2w37vg0
title: BindingDB Entry 50008765: Synthesis and biological activities of topoisomerase I inhibitors, 6-N-amino analogues of NB-506.

description: Small molecule binding data for protein DNA topoisomerase I (Topo I), DNA topoisomerase II, Epidermal growth factor receptor, and Protein kinase C alpha type, Uniprot P00533, P11387, P11388, P17252, and Q02880
DOI: 10.7270/q2w66jvv
title: BindingDB Entry 50006596: Inhibitors of acyl-CoA:cholesterol O-acyltransferase. synthesis and pharmacological activity of (+/-)-2-dodecyl-alpha-phenyl-N-(2,4,6-trimethoxyphenyl)-2H-tetrazole-5- acetamide and structurally related tetrazole amide derivatives.

description: Small molecule binding data for protein Acyl-CoA:cholesterol acyltransferase and Sterol O-acyltransferase, Soat, Uniprot O70536
DOI: 10.7270/q2x066b7
title: BindingDB Entry 50010970: Protease inhibitors: synthesis of a series of bacterial collagenase inhibitors of the sulfonyl amino acyl hydroxamate type.

description: Small molecule binding data for protein Microbial collagenase, Uniprot P43153
DOI: 10.7270/q22r3qq2
title: BindingDB Entry 50006628: Ligand interactions with E-selectin. Identification of a new binding site for recognition of N-acyl aromatic glucosamine substituents of sialyl Lewis X.

description: Small molecule binding data for protein Selectin E, Uniprot P16581
DOI: 10.7270/q23j3c8b
title: BindingDB Entry 50010998: Selective inhibition of Src SH2 by a novel thiol-targeting tricarbonyl-modified inhibitor and mechanistic analysis by (1)H/(13)C NMR spectroscopy.

description: Small molecule binding data for protein VEGF-receptor 2 and tyrosine-protein kinase SRC, Uniprot P12931
DOI: 10.7270/q23j3cb7
title: BindingDB Entry 50013033: Azido-containing aryl beta-diketo acid HIV-1 integrase inhibitors.

description: Small molecule binding data for protein Human immunodeficiency virus type 1 integrase
DOI: 10.7270/q26972x5
title: BindingDB Entry 50013041: Design, synthesis, and pharmacological profile of novel fused pyrazolo[4,3-d]pyridine and pyrazolo[3,4-b][1,8]naphthyridine isosteres: a new class of potent and selective acetylcholinesterase inhibitors.

description: Small molecule binding data for protein Acetylcholinesterase and Acetylcholinesterase and butyrylcholinesterase (AChE and BChE), Uniprot P37136
DOI: 10.7270/q26d5s6q
title: BindingDB Entry 50008799: Synthesis and evaluation of new sulfur-containing L-arginine-derived inhibitors of nitric oxide synthase.

description: Small molecule binding data for protein Nitric Oxide Synthase, inducible, Nitric oxide synthase, brain, and Nitric-oxide synthase (endothelial and brain), Uniprot P29475 and P29477
DOI: 10.7270/q26h4gg7
title: BindingDB Entry 50006627: Geranylgeranyl diphosphate-based inhibitors of post-translational geranylgeranylation of cellular proteins.

description: Small molecule binding data for protein Geranylgeranyl transferase type I beta subunit/Protein Farnesyltransferase (PFT) and Protein Farnesyltransferase (PFT) Chain B, Uniprot P49354, P49356, and P53609
DOI: 10.7270/q27943z6
title: BindingDB Entry 50010997: [3H]MFZ 2-12: a novel radioligand for the dopamine transporter.

description: Small molecule binding data for protein Sodium-dependent dopamine transporter, Uniprot Q01959
DOI: 10.7270/q279442z
title: BindingDB Entry 50013031: Inhibitors of Abeta production: solid-phase synthesis and SAR of alpha-hydroxycarbonyl derivatives.

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, Uniprot P49768, P49810, Q8WW43, Q92542, Q96BI3, and Q9NZ42
DOI: 10.7270/q27d2tb3
title: BindingDB Entry 50008777: Synthesis and in vitro and in vivo evaluation of the 2-(6'methoxy-3',4'-dihydro-1'-naphtyl)-4H-3,1-benzoxazin-4- one as a new potent substrate inhibitor of human leukocyte elastase.

description: Small molecule binding data for protein Leukocyte elastase, Uniprot P08246
DOI: 10.7270/q2b56hzg
title: BindingDB Entry 50008794: Tyrosine kinase inhibitors. 15. 4-(Phenylamino)quinazoline and 4-(phenylamino)pyrido[d]pyrimidine acrylamides as irreversible inhibitors of the ATP binding site of the epidermal growth factor receptor.

description: Small molecule binding data for protein Epidermal growth factor receptor and Epidermal growth factor receptor and ErbB2 (HER1 and HER2), Uniprot P00533 and P04626
DOI: 10.7270/q2b8576z
title: BindingDB Entry 50006625: 2-substituted piperazines as constrained amino acids. Application to the synthesis of potent, non carboxylic acid inhibitors of farnesyltransferase.

description: Small molecule binding data for protein Geranylgeranyl Transferase (GGTase-I), Protein Farnesyltransferase (PFT) Chain B, and Protein Farnesyltransferase (PFT)/farnesyltransferase beta subunit, Uniprot P29702, P49356, Q02293, Q04631, and Q5EAD5
DOI: 10.7270/q2bz65b6
title: BindingDB Entry 50010996: Nucleoside analogues as highly potent and selective inhibitors of herpes simplex virus thymidine kinase.

description: Small molecule binding data for protein Thymidine kinase, Uniprot P06479
DOI: 10.7270/q2ft8kdc
title: BindingDB Entry 50013038: Design and synthesis of naphthalenic dimers as selective MT1 melatoninergic ligands.

description: Small molecule binding data for protein Melatonin receptor, Uniprot P48039 and P49286
DOI: 10.7270/q2fx78nf
title: BindingDB Entry 50008790: Design, synthesis, and activity of 2,6-diphenoxypyridine-derived factor Xa inhibitors.

description: Small molecule binding data for protein Coagulation factor X/antithrombin III, Prothrombin, and Trypsin, Uniprot P00734, P00742, and P00760
DOI: 10.7270/q2g15zxw
title: BindingDB Entry 50006622: Alkyl and alkoxyethyl antineoplastic phospholipids.

description: Small molecule binding data for protein Cyclin-dependent kinase 1 and phosphatase Cdc25, Uniprot P06493 and P30304
DOI: 10.7270/q2gt5mjr
title: BindingDB Entry 50013029: 3,4-Diaryl-5-hydroxyfuranones: highly selective inhibitors of cyclooxygenase-2 with aqueous solubility.

description: Small molecule binding data for protein Cyclooxygenase and Cyclooxygenase-1 (COX-1), Uniprot P23219 and P35354
DOI: 10.7270/q2js9pjc
title: BindingDB Entry 50006643: A structure-activity relationship study of novel phenylacetamides which are sodium channel blockers.

description: Small molecule binding data for protein Sodium channel protein type II alpha subunit, Uniprot P04775
DOI: 10.7270/q2kk9b43
title: BindingDB Entry 50013037: Discovery of tyrosine-based potent and selective melanocortin-1 receptor small-molecule agonists with anti-inflammatory properties.

description: Small molecule binding data for protein Melanocortin receptor 3 (MC3R), Melanocortin receptor 4, Melanocortin receptor 5 (MC5R), and Melanocyte-stimulating hormone receptor, Uniprot P32245, P33032, P41968, and Q01726
DOI: 10.7270/q2kp81bq
title: BindingDB Entry 50008788: Homology modeling of gelatinase catalytic domains and docking simulations of novel sulfonamide inhibitors.

description: Small molecule binding data for protein Collagenase, Uniprot P08253 and P14780
DOI: 10.7270/q2ks6qn9
title: BindingDB Entry 50006620: Synthesis and biological activity of 3- and 5-amino derivatives of pyridine-2-carboxaldehyde thiosemicarbazone.

description: Small molecule binding data for protein Ribonucleoside-diphosphate reductase RR1, Uniprot P31350
DOI: 10.7270/q2mg7nsv
title: BindingDB Entry 50010992: Quinoline-4-acetamides as sPLA(2) inhibitors.

description: Small molecule binding data for protein Group X secretory phospholipase A2, Uniprot O15496
DOI: 10.7270/q2q81cb9
title: BindingDB Entry 50011005: Total synthesis of human chymase inhibitor methyllinderone and structure--activity relationships of its derivatives.

description: Small molecule binding data for protein Chymase, Uniprot P23946
DOI: 10.7270/q2q81cfn
title: BindingDB Entry 50013036: Pyrrolopyrazinedione-based inhibitors of human hormone-sensitive lipase.

description: Small molecule binding data for protein Hormone-sensitive lipase (HSL), Uniprot Q05469
DOI: 10.7270/q2qc02pq
title: BindingDB Entry 50008785: 4-[[2-(1-Methyl-2-pyrrolidinyl)ethyl]thio]phenol hydrochloride (SIB-1553A): a novel cognitive enhancer with selectivity for neuronal nicotinic acetylcholine receptors.

description: Small molecule binding data for protein Cholinergic, Nicotinic Muscle, Uniprot P43144
DOI: 10.7270/q2qj7gc1
title: BindingDB Entry 50006619: Esters and amides of 6-(chloromethyl)-2-oxo-2H-1-benzopyran-3-carboxylic acid as inhibitors of alpha-chymotrypsin: significance of the"aromatic" nature of the novel ester-type coumarin for strong inhibitory activity.

description: Small molecule binding data for protein Alpha-chymotrypsin, Uniprot P00766
DOI: 10.7270/q2r78dhk
title: BindingDB Entry 50010991: Dibasic inhibitors of human mast cell tryptase. Part 3: identification of a series of potent and selective inhibitors containing the benzamidine functionality.

description: Small molecule binding data for protein Plasminogen, Prothrombin, Trypsin, and Tryptase, Uniprot P00734, P00747, P07477, P07478, P35030, Q15661,P20231, Q9BZJ3, and Q9NRR2
DOI: 10.7270/q2v12421
title: BindingDB Entry 50011004: Inhibition of serine proteases: activity of 1,3-diazetidine-2,4-diones.

description: Small molecule binding data for protein Cathepsin G, Chymase, Chymotrypsin, Leukocyte elastase, Plasminogen, Prothrombin, and Trypsin, Uniprot P00734, P00747, P00760, P08246, P08311, P23946, and Q99895
DOI: 10.7270/q2v1244x
title: BindingDB Entry 50013035: Synthesis and biological evaluation of non-peptidic cyclophilin ligands.

description: Small molecule binding data for protein Cyclophilin A, Uniprot P10111
DOI: 10.7270/q2v40tcm
title: BindingDB Entry 50008783: Synthesis of novel analogues of the delta opioid ligand SNC-80 using AlCl3-promoted aminolysis.

description: Small molecule binding data for protein Delta-type opioid receptor, Nociceptin/mu opioid receptor, and mu/kappa opioid receptor, Uniprot P33535, P41143, and P41144
DOI: 10.7270/q2z0377g
title: BindingDB Entry 50006633: The squalestatins: inhibitors of squalene synthase. Enzyme inhibitory activities and in vivo evaluation of C3-modified analogues.

description: Small molecule binding data for protein Squalene synthetase, Uniprot Q02769
DOI: 10.7270/q2zs2vvj
title: BindingDB Entry 50013034: Antiestrogens and selective estrogen receptor modulators as multifunctional medicines. 2. Clinical considerations and new agents.

description: Small molecule binding data for protein Estradiol receptor alpha (ERα), Uniprot P03372
DOI: 10.7270/q2zw1k31
title: BindingDB Entry 50008781: Optimisation of the P2 pharmacophore in a series of thrombin inhibitors: ion-dipole interactions with lysine 60G.

description: Small molecule binding data for protein Prothrombin, Uniprot P00734
DOI: 10.7270/q21j994c
title: BindingDB Entry 50013071: Structure-activity relationship of cyclic peptide penta-c[Asp-His(6)-DPhe(7)-Arg(8)-Trp(9)-Lys]-NH(2) at the human melanocortin-1 and -4 receptors: His(6) substitution.

description: Small molecule binding data for protein Melanocortin receptor 3 (MC3R), Melanocortin receptor 4, Melanocortin receptor 5 (MC5R), and Melanocyte-stimulating hormone receptor, Uniprot P32245, P33032, P41968, and Q01726
DOI: 10.7270/q21r6pm4
title: BindingDB Entry 50006651: Pyrrolobenzothiazepinones and pyrrolobenzoxazepinones: novel and specific non-nucleoside HIV-1 reverse transcriptase inhibitors with antiviral activity.

description: Small molecule binding data for protein Human immunodeficiency virus type 1 protease and Human immunodeficiency virus type 1 reverse transcriptase
DOI: 10.7270/q22j6b4z
title: BindingDB Entry 50011020: Isomerization of (Z,Z) to (E,E)1-bromo-2,5-bis-(3-hydroxycarbonyl-4-hydroxy)styrylbenzene in strong base: probes for amyloid plaques in the brain.

description: Small molecule binding data for protein Beta amyloid A4 protein, Uniprot P05067
DOI: 10.7270/q22j6b6v
title: BindingDB Entry 50013042: Use of a pharmacophore model to discover a new class of influenza endonuclease inhibitors.

description: Small molecule binding data for protein PA/PB1 and Polymerase acidic protein, Uniprot P03433 and Q9QLI9
DOI: 10.7270/q22n51gc
title: BindingDB Entry 50008801: Synthesis of novel phenserine-based-selective inhibitors of butyrylcholinesterase for Alzheimer's disease.

description: Small molecule binding data for protein Acetylcholinesterase and Cholinesterase, Uniprot P06276 and P22303
DOI: 10.7270/q25d8r1w
title: BindingDB Entry 50008817: New generation dopaminergic agents. 6. Structure-activity relationship studies of a series of 4-(aminoethoxy)indole and 4-(aminoethoxy)indolone derivatives based on the newly discovered 3-hydroxyphenoxyethylamine D2 template.

description: Small molecule binding data for protein Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor and Serotonin (5-HT) receptor, Uniprot P19327 and P61169
DOI: 10.7270/q25h7fbv
title: BindingDB Entry 50006650: (S)-13-[(dimethylamino)methyl]-10,11,14,15-tetrahydro-4,9:16, 21-dimetheno-1H, 13H-dibenzo[e,k]pyrrolo[3,4-h][1,4,13]oxadiazacyclohexadecene-1,3(2H)-d ione (LY333531) and related analogues: isozyme selective inhibitors of protein kinase C beta.

description: Small molecule binding data for protein PKC alpha and beta-2, Protein kinase C (PKC), Protein kinase C alpha type, Protein kinase C delta type, Protein kinase C, epsilon, Protein kinase C, eta, Protein kinase C, gamma, and VEGF-receptor 2 and tyrosine-protein kinase SRC, Uniprot P05129, P05771, P12931, P17252, P24723, Q02156, Q05513, and Q05655
DOI: 10.7270/q26972v8
title: BindingDB Entry 50011015: Significance of hydrogen bonding at the S(1)' subsite of calpain I.

description: Small molecule binding data for protein Calpain small subunit 1, Uniprot P04574
DOI: 10.7270/q2988631
title: BindingDB Entry 50006649: Discovery of novel retinoic acid receptor agonists having potent antiproliferative activity in cervical cancer cells.

description: Small molecule binding data for protein RXR alpha/PPAR gamma, Retinoid X receptor gamma/retinoic acid receptor alpha, and Retinoid receptor, Uniprot P10276, P10826, P13631, P19793, P28702, and P48443
DOI: 10.7270/q2b27tj5
title: BindingDB Entry 50011012: Isoindolines: a new series of potent and selective endothelin-A receptor antagonists.

description: Small molecule binding data for protein EDNRA and EDNRB, Uniprot P24530 and P25101
DOI: 10.7270/q2b27tnh
title: BindingDB Entry 50013040: Virtual screening for submicromolar leads of tRNA-guanine transglycosylase based on a new unexpected binding mode detected by crystal structure analysis.

description: Small molecule binding data for protein tRNA-guanine transglycosylase (TGT), Uniprot P28720
DOI: 10.7270/q2dv1j8j
title: BindingDB Entry 50013068: Synthesis and biological evaluation of 4-[3-biphenyl-2-yl-1-hydroxy-1-(3-methyl-3H-imidazol-4-yl)-prop-2-ynyl]-1-yl-benzonitrile as novel farnesyltransferase inhibitor.

description: Small molecule binding data for protein Geranylgeranyl transferase type I and Protein Farnesyltransferase (PFT) Chain B, Uniprot P49356 and P53609
DOI: 10.7270/q2dz07hm
title: BindingDB Entry 50008813: Unique analogues of anandamide: arachidonyl ethers and carbamates and norarachidonyl carbamates and ureas.

description: Small molecule binding data for protein Cannabinoid receptor, Uniprot P20272
DOI: 10.7270/q2f18xtz
title: BindingDB Entry 50006645: Inhibition of human glutathione reductase by 10-arylisoalloxazines: crystalline, kinetic, and electrochemical studies.

description: Small molecule binding data for protein Glutathione reductase (GR), Uniprot P00390
DOI: 10.7270/q2fq9vw9
title: BindingDB Entry 50011011: Potent nonpeptide GnRH receptor antagonists derived from substituted indole-5-carboxamides and -acetamides bearing a pyridine side-chain terminus.

description: Small molecule binding data for protein Gonadotropin-releasing hormone receptor, Uniprot P30968 and P30969
DOI: 10.7270/q2ht2ndj
title: BindingDB Entry 50006670: (S)-(+)-2-(3'-carboxybicyclo[1.1.1]pentyl)-glycine, a structurally new group I metabotropic glutamate receptor antagonist.

description: Small molecule binding data for protein Metabotropic glutamate receptor 1, Metabotropic glutamate receptor 2 (mGluR2), Metabotropic glutamate receptor 4 (mGluR4), and Metabotropic glutamate receptor 5, Uniprot P41594, Q13255, Q14416, and Q14833
DOI: 10.7270/q2jh3kfr
title: BindingDB Entry 50011027: A new concept for multidimensional selection of ligand conformations (MultiSelect) and multidimensional scoring (MultiScore) of protein-ligand binding affinities.

description: Small molecule binding data for protein Collagenase, Matrix metalloproteinase-1 (MMP1), and Stromelysin-1, Uniprot P03956, P08253, and P08254
DOI: 10.7270/q2jm291q
title: BindingDB Entry 50013067: [3H]-(R)-NPTS, a radioligand for the type 1 glycine transporter.

description: Small molecule binding data for protein Glycine transporter 1, Uniprot P48067
DOI: 10.7270/q2jq106w
title: BindingDB Entry 50008812: Low-molecular-weight peptidic and cyclic antagonists of the receptor for the complement factor C5a.

description: Small molecule binding data for protein C5a anaphylatoxin chemotactic receptor (C5aR), Uniprot P21730
DOI: 10.7270/q2kh0mk4
title: BindingDB Entry 50011010: Substituted indole-5-carboxamides and -acetamides as potent nonpeptide GnRH receptor antagonists.

description: Small molecule binding data for protein Gonadotropin-releasing hormone receptor, Uniprot P30969
DOI: 10.7270/q2nk3d48
title: BindingDB Entry 50006667: New steroidal diazo ketones as potential photoaffinity labeling reagents for the mineralocorticoid receptor: synthesis and biological activities.

description: Small molecule binding data for protein Mineralocorticoid receptor (MR), Uniprot P08235
DOI: 10.7270/q2p84b41
title: BindingDB Entry 50011023: Enantioselective syntheses of potent retinoid X receptor ligands: differential biological activities of individual antipodes.

description: Small molecule binding data for protein RXR alpha/PPAR gamma, Retinoid X receptor gamma/retinoic acid receptor alpha, and Retinoid receptor, Uniprot P10276, P10826, P13631, P19793, P28702, and P48443
DOI: 10.7270/q2pc31r1
title: BindingDB Entry 50013065: Phenylacetic acid derivatives as hPPAR agonists.

description: Small molecule binding data for protein Peroxisome proliferator-activated receptor, Peroxisome proliferator-activated receptor alpha (PPAR alpha), and Peroxisome proliferator-activated receptor delta (PPAR delta), Uniprot P37231, Q03181, and Q07869