cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2862gs1
title: BindingDB Entry 50033612: Aryl 1,4-diazepane compounds as potent and selective CB2 agonists: optimization of drug-like properties and target independent parameters.

description: Small molecule binding data for protein Cannabinoid receptor 2, Uniprot P34972
DOI: 10.7270/q28w3dks
title: BindingDB Entry 50032819: TBA

description: Small molecule binding data for protein Cytochrome P450 11B2 and Steroid 11-beta-Hydroxylase (CYP11B1), Uniprot P15538 and P19099
DOI: 10.7270/q2cn74bc
title: BindingDB Entry 50034476: A new generation of radiofluorinated pyrimidine-2,4,6-triones as MMP-targeted radiotracers for positron emission tomography.

description: Small molecule binding data for protein Collagenase and Matrix Metalloproteinase-8 (MMP-8), Uniprot P08253, P14780, P22894, and P45452
DOI: 10.7270/q2cv4j9t
title: BindingDB Entry 50035280: Noncovalent tripeptidic thrombin inhibitors incorporating amidrazone, amine and amidine functions at P1.

description: Small molecule binding data for protein Coagulation factor X/antithrombin III, Prothrombin, and Trypsin, Uniprot P00734, P00742, and P00760
DOI: 10.7270/q2cz37hf
title: BindingDB Entry 50033611: Discovery of a novel class of 2-aminopyrimidines as CDK1 and CDK2 inhibitors.

description: Small molecule binding data for protein Cyclin-dependent kinase 1 and Cyclin-dependent kinase 2, Uniprot P06493 and P24941
DOI: 10.7270/q2dj5fws
title: BindingDB Entry 50032796: Discovery of 1-(3,4-dichlorophenyl)-N,N-dimethyl-1,2,3,4-tetrahydroquinolin-4-amine, a dual serotonin and dopamine reuptake inhibitor.

description: Small molecule binding data for protein Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Serotonin and norepinephrine transporters (SERT/NET), Sodium-dependent dopamine transporter, Sodium-dependent noradrenaline transporter, and Voltage-gated potassium channel, Uniprot P08684, P10635, P11712, P23975, P31645, P33261, Q01959, and Q12809
DOI: 10.7270/q2gf0txg
title: BindingDB Entry 50034483: Structure-activity relationships for amide-, carbamate-, and urea-linked analogues of the tuberculosis drug (6S)-2-nitro-6-{[4-(trifluoromethoxy)benzyl]oxy}-6,7-dihydro-5H-imidazo[2,1-b][1,3]oxazine (PA-824).

description: Small molecule binding data for protein Voltage-gated potassium channel, Uniprot Q12809
DOI: 10.7270/q2hd7w35
title: BindingDB Entry 50034475: Potent galloyl-based selective modulators targeting multidrug resistance associated protein 1 and P-glycoprotein.

description: Small molecule binding data for protein Multidrug resistance-associated protein 1 and P-glycoprotein 1, Uniprot P08183 and P33527
DOI: 10.7270/q2hm591j
title: BindingDB Entry 50035279: Benzimidazole-4,7-diones as inhibitors of protozoal (Toxoplasma gondii) purine nucleoside phosphorylase.

description: Small molecule binding data for protein Purine nucleoside phosphorylase, Uniprot P00491
DOI: 10.7270/q2j966mh
title: BindingDB Entry 50032795: Discovery of pyrazolo[1,5-a]pyrimidine-based CHK1 inhibitors: a template-based approach--part 1.

description: Small molecule binding data for protein CDK2/Cyclin A/Cyclin A1 and Serine/threonine-protein kinase Chk1, Uniprot O14757, P20248, P24941, and P78396
DOI: 10.7270/q2m61kpn
title: BindingDB Entry 50034482: Discovery of kinase spectrum selective macrocycle (16E)-14-methyl-20-oxa-5,7,14,26-tetraazatetracyclo[19.3.1.1(2,6).1(8,12)]heptacosa-1(25),2(26),3,5,8(27),9,11,16,21,23-decaene (SB1317/TG02), a potent inhibitor of cyclin dependent kinases (CDKs), Janus kinase 2 (JAK2), and fms-like tyrosine kinase

description: Small molecule binding data for protein Cyclin-Dependent Kinase 2 (CDK2), Cyclin-dependent kinase 2, Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Tyrosine-protein kinase JAK2, and Tyrosine-protein kinase receptor FLT3, Uniprot O60674, P05177, P08684, P10635, P11712, P20248, P24941, P33261, and P36888
DOI: 10.7270/q2mg7pv5
title: BindingDB Entry 50033622: Allosteric and ATP-competitive kinase inhibitors of mTOR for cancer treatment.

description: Small molecule binding data for protein PI3-kinase subunit alpha and Serine/threonine-protein kinase mTOR, Uniprot P42336 and P42345
DOI: 10.7270/q2nc61s9
title: BindingDB Entry 50035278: Design, synthesis and bioactivity evaluation of tribactam beta lactamase inhibitors.

description: Small molecule binding data for protein Beta-lactamase (TEM-1) and Beta-lactamase class C, Uniprot P62593
DOI: 10.7270/q2ng4qz3
title: BindingDB Entry 50033609: Biphenyl-substituted oxazolidinones as cholesteryl ester transfer protein inhibitors: modifications of the oxazolidinone ring leading to the discovery of anacetrapib.

description: Small molecule binding data for protein Cholesteryl ester transfer protein, Uniprot P11597
DOI: 10.7270/q2p26zc9
title: BindingDB Entry 50032794: Discovery of pyrazolo[1,5-a]pyrimidine-based CHK1 inhibitors: a template-based approach--part 2.

description: Small molecule binding data for protein CDK2/Cyclin A/Cyclin A1 and Serine/threonine-protein kinase Chk1, Uniprot O14757, P20248, P24941, and P78396
DOI: 10.7270/q2r78fjf
title: BindingDB Entry 50033620: Comparative molecular field analysis of fenoterol derivatives: A platform towards highly selective and effective beta(2)-adrenergic receptor agonists.

description: Small molecule binding data for protein Adrenergic receptor beta, Beta-1 adrenergic receptor, and Beta-2 adrenergic receptor and beta-3 adrenergic receptor, Uniprot P07550, P08588, P10608, and P18090
DOI: 10.7270/q2s46sbd
title: BindingDB Entry 50033608: Design, synthesis and evaluation of monovalent Smac mimetics that bind to the BIR2 domain of the anti-apoptotic protein XIAP.

description: Small molecule binding data for protein X-linked inhibitor of apoptosis protein (XIAP), Uniprot P98170
DOI: 10.7270/q2s46shn
title: BindingDB Entry 50035277: Syntheses and binding affinities of 6-nitroquipazine analogues for serotonin transporter. Part 2: 4-substituted 6-nitroquipazines.

description: Small molecule binding data for protein Sodium-dependent serotonin transporter, Uniprot P31652
DOI: 10.7270/q2st7q3q
title: BindingDB Entry 50032793: Discovery of isoindoline and tetrahydroisoquinoline derivatives as potent, selective PPARd 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
DOI: 10.7270/q2vq334s
title: BindingDB Entry 50034480: Structure-activity relationships of truncated C2- or C8-substituted adenosine derivatives as dual acting A2A and A3 adenosine receptor ligands.

description: Small molecule binding data for protein Adenosine receptor A1, Adenosine receptor A2a, and Adenosine receptor A3, Uniprot P0DMS8, P29274, and P30542
DOI: 10.7270/q2vx0gw4
title: BindingDB Entry 50033618: Discovery of omecamtiv mecarbil the first, selective, small molecule activator of cardiac Myosin.

description: Small molecule binding data for protein Cytochrome P450 1A, Uniprot P05177
DOI: 10.7270/q2wq047q
title: BindingDB Entry 50034472: Hydroxylated analogues of ATP-sensitive potassium channel openers belonging to the group of 6- and/or 7-substituted 3-isopropylamino-4H-1,2,4-benzothiadiazine 1,1-dioxides: toward an improvement in sulfonylurea receptor 1 selectivity and metabolism stability.

description: Small molecule binding data for protein ATP-binding cassette sub-family C member 8, Uniprot Q09429
DOI: 10.7270/q2ws8tsw
title: BindingDB Entry 50035276: Potent nonsteroidal progesterone receptor agonists: synthesis and SAR study of 6-aryl benzoxazines.

description: Small molecule binding data for protein Progesterone receptor, Uniprot P06401
DOI: 10.7270/q2xk8ft1
title: BindingDB Entry 50032792: 2-Arylbenzoxazoles as CETP inhibitors: raising HDL-C in cynoCETP transgenic mice.

description: Small molecule binding data for protein Cholesteryl ester transfer protein, Uniprot P11597
DOI: 10.7270/q20c4w14
title: BindingDB Entry 50032834: Novel S-adenosylmethionine decarboxylase inhibitors for the treatment of human African trypanosomiasis.

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/q20k294r
title: BindingDB Entry 50035283: Thiophene derivatives: a new series of potent norepinephrine and serotonin reuptake inhibitors.

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/q237795k
title: BindingDB Entry 50034486: High-affinity fluorescent ligands for the 5-HT(3) receptor.

description: Small molecule binding data for protein Serotonin 3 (5-HT3) receptor, Uniprot P46098
DOI: 10.7270/q23b60p7
title: BindingDB Entry 50035291: Structure-activity relationship on human serum paraoxonase (PON1) using substrate analogues and inhibitors.

description: Small molecule binding data for protein Serum paraoxonase/arylesterase 1, Uniprot P27169
DOI: 10.7270/q23f4q07
title: BindingDB Entry 50033626: Spiroindane based amides as potent and selective MC4R agonists for the treatment of obesity.

description: Small molecule binding data for protein Melanocortin receptor 3 and Melanocortin receptor 4, Uniprot P32245, P33033, and P56450
DOI: 10.7270/q2445mrf
title: BindingDB Entry 50032832: Novel plasmid-encoded ceftazidime-hydrolyzing CTX-M-53 extended-spectrum beta-lactamase from Salmonella enterica serotypes Westhampton and Senftenberg.

description: Small molecule binding data for protein Extended-spectrum beta-lactamase CTX-M-53
DOI: 10.7270/q26w9bj5
title: BindingDB Entry 50034485: Heteroaromatic-aminomethyl quinolones: potent and selective iNOS inhibitors.

description: Small molecule binding data for protein Nitric Oxide Synthase, inducible, Nitric oxide synthase, brain, Nitric oxide synthase, inducible, and Nitric-oxide synthase (endothelial and brain), Uniprot P29475, P29477, and P35228
DOI: 10.7270/q2736rf1
title: BindingDB Entry 50035290: N,N-disubstituted piperazines: synthesis and affinities at alpha4beta2(*) and alpha7(*) neuronal nicotinic acetylcholine receptors.

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/q2765fnn
title: BindingDB Entry 50033625: In vivo and in vitro SAR of tetracyclic MAPKAP-K2 (MK2) inhibitors. Part I.

description: Small molecule binding data for protein MAP kinase-activated protein kinase 2 and Mitogen-activated protein kinase 9, Uniprot P45984 and P49137
DOI: 10.7270/q27w6cgv
title: BindingDB Entry 50032831: Inactivation of the glycoside hydrolase NagZ attenuates antipseudomonal beta-lactam resistance in Pseudomonas aeruginosa.

description: Small molecule binding data for protein Beta-hexosaminidase, Uniprot Q9HZK0
DOI: 10.7270/q29s1rg3
title: BindingDB Entry 50034492: Discovery of 3-aryloxy-lactam analogs as potent androgen receptor full antagonists for treating castration resistant prostate cancer.

description: Small molecule binding data for protein Androgen Receptor, Uniprot P10275
DOI: 10.7270/q2bp0370
title: BindingDB Entry 50034484: Design, synthesis, and anaplastic lymphoma kinase (ALK) inhibitory activity for a novel series of 2,4,8,22-tetraazatetracyclo[14.3.1.1³,¿?¿.1¿?¿,¹³]docosa-1(20),3(22),4,6,9(21),10,12,16,18-nonaene macrocycles.

description: Small molecule binding data for protein ALK tyrosine kinase receptor, Uniprot Q9UM73
DOI: 10.7270/q2bv7h5f
title: BindingDB Entry 50035289: Structure-activity relationship of linear peptide Bu-His-DPhe-Arg-Trp-Gly-NH(2) at the human melanocortin-1 and -4 receptors: histidine 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/q2bz66c2
title: BindingDB Entry 50033624: In vivo and in vitro SAR of tetracyclic MAPKAP-K2 (MK2) inhibitors. Part II.

description: Small molecule binding data for protein MAP kinase-activated protein kinase 2, Uniprot P49137
DOI: 10.7270/q2cn7454
title: BindingDB Entry 50032829: Genetic variability among ampC genes from acinetobacter genomic species 3.

description: Small molecule binding data for protein ADC-14 protein, ADC-16 protein, and ADC-18 protein
DOI: 10.7270/q2gm87v9
title: BindingDB Entry 50035288: Design of novel N-(2,4-dioxo-1,2,3,4-tetrahydro-thieno[3,2-d]pyrimidin-7-yl)-guanidines as thymidine phosphorylase inhibitors, and flexible docking to a homology model.

description: Small molecule binding data for protein Thymidine Phosphorylase (TP), Uniprot P19971
DOI: 10.7270/q2gq6z3d
title: BindingDB Entry 50033623: Pyrazolopyridazine alpha-2-delta-1 ligands for the treatment of neuropathic pain.

description: Small molecule binding data for protein Voltage-gated calcium channel, Voltage-gated calcium channel subunit alpha-2/delta, and Voltage-gated potassium channel, Uniprot P54289, Q12809, and Q9NY47
DOI: 10.7270/q2h995g4
title: BindingDB Entry 50032828: TBA

description: Small molecule binding data for protein Sphingosine 1-Phosphate Receptor 5, Sphingosine 1-phosphate receptor, and Sphingosine 1-phosphate receptor 3, Uniprot P21453, Q99500, and Q9H228
DOI: 10.7270/q2kh0nqb
title: BindingDB Entry 50033630: Orally active MMP-1 sparinga-tetrahydropyranyl anda-piperidinyl sulfone matrix metalloproteinase (MMP) inhibitors with efficacy in cancer, arthritis, and cardiovascular disease.

description: Small molecule binding data for protein Collagenase, Matrix Metalloproteinase-8 (MMP-8), Matrix metalloproteinase-1 (MMP1), Matrix metalloproteinase-14 (MMP14), Matrix metalloproteinase-7 (MMP7), and Stromelysin-1, Uniprot P03956, P08253, P08254, P09237, P14780, P22894, P45452, and P50281
DOI: 10.7270/q2mc90k1
title: BindingDB Entry 50035287: The mechanism of the irreversible inhibition of estrone sulfatase (ES) through the consideration of a range of methane- and amino-sulfonate-based compounds.

description: Small molecule binding data for protein Steroid Sulfatase (STS), Uniprot P08842
DOI: 10.7270/q2n29x6g
title: BindingDB Entry 50032827: TBA

description: Small molecule binding data for protein Collagenase, Matrix metalloproteinase-1 (MMP1), Matrix metalloproteinase-14 (MMP14), Matrix metalloproteinase-7 (MMP7), and Stromelysin-1, Uniprot P03956, P08253, P08254, P09237, P14780, and P50281
DOI: 10.7270/q2pz598p
title: BindingDB Entry 50034489: Identification of triazolopyridazinones as potent p38a inhibitors.

description: Small molecule binding data for protein Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Mitogen-activated protein kinase 14, and Voltage-gated potassium channel, Uniprot P08684, P10635, Q12809, and Q16539
DOI: 10.7270/q2q81dgh
title: BindingDB Entry 50033629: Discovery of imidazo[1,2-a]pyrazine-based Aurora kinase inhibitors.

description: Small molecule binding data for protein AKT/p21CIP1, Aurora kinase B/Inner centromere protein, CaM kinase IV, Casein kinase I isoform delta, Cyclin-dependent kinase 2, Epidermal growth factor receptor, Hepatocyte growth factor receptor, Inhibitor of NF-kappa-B kinase (IKK), Interleukin-1 receptor-associated kinase 4, MAP kinase ERK2, Protein kinase C alpha type, Rho-associated protein kinase, Ribosomal protein S6 kinase alpha 3, SRC, Serine/threonine-protein kinase Aurora, Serine/threonine-protein kinase Chk1, Serine/threonine-protein kinase MST2, Serine/threonine-protein kinase PLK3, Testis-specific serine/threonine-protein kinase 2, Tyrosine-protein kinase JAK2, and Vascular endothelial growth factor receptor 2, Uniprot O14757, O14920, O14965, O60674, O75116, P00533, P06239, P08581, P17252, P24941, P28482, P31749, P35968, P48730, P51812, Q13188, Q16566, Q96GD4, Q96PF2, Q9H4B4, and Q9NWZ3
DOI: 10.7270/q2qz2bd2
title: BindingDB Entry 50034481: Amide-modified prenylcysteine based Icmt inhibitors: Structure-activity relationships, kinetic analysis and cellular characterization.

description: Small molecule binding data for protein Isoprenylcysteine carboxyl methyltransferase, Uniprot O60725
DOI: 10.7270/q2r49rbt
title: BindingDB Entry 50035286: Design, synthesis and biological activity of novel non-peptidyl endothelin converting enzyme inhibitors, 1-phenyl-tetrazole-formazan analogues.

description: Small molecule binding data for protein Endothelin-converting enzyme 1 (ECE), Uniprot P42893
DOI: 10.7270/q2rv0nzg
title: BindingDB Entry 50032825: TBA

description: Small molecule binding data for protein Follicle stimulating hormone receptor and Luteinizing hormone/Choriogonadotropin receptor, Uniprot P22888 and P23945
DOI: 10.7270/q2tq620d
title: BindingDB Entry 50034488: Structure-based library design and the discovery of a potent and selective mast cellß-tryptase inhibitor as an oral therapeutic agent.

description: Small molecule binding data for protein Chymase, Coagulation factor X/antithrombin III, and Prothrombin, Uniprot P00734, P00742, and P23946
DOI: 10.7270/q2v1255s
title: BindingDB Entry 50033628: Synthesis and biological activity of a series of tetrasubstituted-imidazoles as P2X(7) antagonists.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, P2X purinoceptor 7, and P2X purinoceptor 7 (P2X7), Uniprot P05177, P08684, P10635, P11712, P33261, Q64663, and Q99572
DOI: 10.7270/q2vm4chc
title: BindingDB Entry 50032835: Susceptibility of highly pathogenic H5N1 influenza viruses to the neuraminidase inhibitor oseltamivir differs in vitro and in a mouse model.

description: Small molecule binding data for protein Neuraminidase
DOI: 10.7270/q2vx0h2s
title: BindingDB Entry 50035284: Synthesis and in vitro evaluation of a novel iodinated resiniferatoxin derivative that is an agonist at the human vanilloid VR1 receptor.

description: Small molecule binding data for protein Transient receptor potential cation channel subfamily V member 1, Uniprot Q8NER1
DOI: 10.7270/q2wm1dp6
title: BindingDB Entry 50032824: TBA

description: Small molecule binding data for protein Sphingosine 1-phosphate receptor, Sphingosine 1-phosphate receptor 3, and Voltage-gated potassium channel, Uniprot P21453, Q12809, and Q99500
DOI: 10.7270/q2zg6sqb
title: BindingDB Entry 50034487: In vitro and in silico studies on substrate recognition and acceptance of human PKMYT1, a Cdk1 inhibitory kinase.

description: Small molecule binding data for protein Tyrosine- and threonine-specific cdc2-inhibitory kinase, Uniprot Q99640
DOI: 10.7270/q2zs2wvz
title: BindingDB Entry 50033627: Tricyclic imidazole antagonists of the Neuropeptide S Receptor.

description: Small molecule binding data for protein Cannabinoid receptor 1, Neuropeptide S receptor, and Prostanoid TP receptor, Uniprot P21554, P21731, and Q6W5P4
DOI: 10.7270/q228083n
title: BindingDB Entry 50034494: Design, synthesis, and biological evaluation of potent quinoline and pyrroloquinoline ammosamide analogues as inhibitors of quinone reductase 2.

description: Small molecule binding data for protein Ribosyldihydronicotinamide dehydrogenase [quinone], Uniprot P16083
DOI: 10.7270/q22f7p0n
title: BindingDB Entry 50035300: D-Phe-Pro-Arg type thrombin inhibitors: unexpected selectivity by modification of the P1 moiety.

description: Small molecule binding data for protein Prothrombin and Trypsin, Uniprot P00734 and P00760
DOI: 10.7270/q22j6c68
title: BindingDB Entry 50033634: Identification of N-propylnoraporphin-11-yl 5-(1,2-dithiolan-3-yl)pentanoate as a new anti-Parkinson's agent possessing a dopamine D2 and serotonin 5-HT1A dual-agonist profile.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), 5-hydroxytryptamine receptor 1A, Adrenergic alpha1B, Alpha-1A adrenergic receptor, Alpha-1D adrenergic receptor, Beta-2 adrenergic receptor and beta-3 adrenergic receptor, Dopamine D1 and D2 receptor, and Dopamine receptor D2L/neurotensin receptor NTS1, Uniprot P07550, P08908, P14416, P21728, P25100, P28223, P35348, and P35368
DOI: 10.7270/q2348km2
title: BindingDB Entry 50032842: Extended-spectrum cephalosporinase in Acinetobacter baumannii.

description: Small molecule binding data for protein ADC-11 and Beta-lactamase ADC-33
DOI: 10.7270/q2513zp6
title: BindingDB Entry 50034501: Aminopurine based JNK inhibitors for the prevention of ischemia reperfusion injury.

description: Small molecule binding data for protein Mitogen-activated protein kinase 10, Mitogen-activated protein kinase 14, Mitogen-activated protein kinase 9, and c-Jun N-terminal kinase, JNK, Uniprot P45983, P45984, P53779, and Q16539
DOI: 10.7270/q26110sh
title: BindingDB Entry 50034493: Discovery of a novel chemotype of potent human ENaC blockers using a bioisostere approach. Part 1: quaternary amines.

description: Small molecule binding data for protein Voltage-gated potassium channel, Uniprot Q12809
DOI: 10.7270/q2639q86
title: BindingDB Entry 50035299: The role of 2',3'-unsaturation on the antiviral activity of anti-HIV nucleosides against 3TC-resistant mutant (M184V).

description: Small molecule binding data for protein Human immunodeficiency virus type 1 reverse transcriptase
DOI: 10.7270/q2668dk5
title: BindingDB Entry 50033633: Highly improved metabolic stability and pharmacokinetics of indium-111-DOTA-gastrin conjugates for targeting of the gastrin receptor.

description: Small molecule binding data for protein CCKBR and Cholecystokinin receptor, Uniprot P30553, P32238, and P32239
DOI: 10.7270/q26w9bbg
title: BindingDB Entry 50032841: High-throughput screening identifies three inhibitor classes of the telomere resolvase from the lyme disease spirochete.

description: Small molecule binding data for protein Telomere resolvase resT, Uniprot O50979
DOI: 10.7270/q27h1k3q
title: BindingDB Entry 50034997: Rational design of N-[2-(2,5-dimethoxyphenylethyl)]-N'-[2-(5-bromopyridyl)]-thiourea (HI-236) as a potent non-nucleoside inhibitor of drug-resistant human immunodeficiency virus.

description: Small molecule binding data for protein Human immunodeficiency virus type 1 reverse transcriptase
DOI: 10.7270/q29w0g05
title: BindingDB Entry 50035298: Unexpected inhibition of S-adenosyl-L-homocysteine hydrolase by a guanosine nucleoside.

description: Small molecule binding data for protein Adenosylhomocysteinase, Uniprot P23526
DOI: 10.7270/q29z9584
title: BindingDB Entry 50033632: Discovery of dual inducible/neuronal nitric oxide synthase (iNOS/nNOS) inhibitor development candidate 4-((2-cyclobutyl-1H-imidazo[4,5-b]pyrazin-1-yl)methyl)-7,8-difluoroquinolin-2(1H)-one (KD7332) part 2: identification of a novel, potent, and selective series of benzimidazole-quinolinone iNOS/nNO

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Nitric Oxide Synthase, inducible, Nitric oxide synthase, brain, Nitric oxide synthase, inducible, Nitric-oxide synthase (endothelial and brain), and Voltage-gated potassium channel, Uniprot P05177, P08684, P10635, P11712, P29475, P29477, P33261, P35228, and Q12809
DOI: 10.7270/q2bp032r
title: BindingDB Entry 50032840: Curcumin modulates efflux mediated by yeast ABC multidrug transporters and is synergistic with antifungals.

description: Small molecule binding data for protein Multidrug resistance protein CDR1, Uniprot P43071
DOI: 10.7270/q2dj5g2f
title: BindingDB Entry 50034499: Synthesis of 3-phenylsulfonylmethyl cyclohexylaminobenzamide-derived antagonists of CC chemokine receptor 2 (CCR2).

description: Small molecule binding data for protein C-C chemokine receptor type 2 and C-C chemokine receptor type 5, Uniprot O95950, P41597, and P51681