cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.7270/q2rx9cxt
title: BindingDB Entry 50038114: Combinatorial synthesis of anilinoanthraquinone derivatives and evaluation as non-nucleotide-derived P2Y2 receptor antagonists.

description: Small molecule binding data for protein Ecto-5'-nucleotidase (e5'NT), Ectonucleoside triphosphate diphosphohydrolase 1, Purinergic receptor P2Y2, Pyrimidinergic receptor P2Y4, and Pyrimidinergic receptor P2Y6, Uniprot P21588, P35383, P41231, P51582, P97687, and Q63371
DOI: 10.7270/q2th8ngd
title: BindingDB Entry 50037164: Opioid binding and in vitro profiles of a series of 4-hdroxy-3-methoxyindolomorphinans. Transformation of a delta-selective ligand into a high affinity kappa-selective ligand by introduction of a 5,14-substituted bridge.

description: Small molecule binding data for protein Delta-type opioid receptor, Kappa-type opioid receptor, and Mu-type opioid receptor, Uniprot P35372, P41143, and P41145
DOI: 10.7270/q2vq33hq
title: BindingDB Entry 50038121: In vitro and in vivo evaluation of O-alkyl derivatives of tramadol.

description: Small molecule binding data for protein Mu-type opioid receptor, Serotonin and norepinephrine transporters (SERT/NET), and Sodium-dependent noradrenaline transporter, Uniprot P23975, P31645, and P35372
DOI: 10.7270/q2w37x84
title: BindingDB Entry 50039032: Structure-activity relationships of the ultrapotent vanilloid resiniferatoxin (RTX): The side chain benzylic methylene.

description: Small molecule binding data for protein Transient receptor potential cation channel subfamily V member 1, Uniprot Q8NER1
DOI: 10.7270/q2w66mt7
title: BindingDB Entry 50039854: 2-Anilino-4-(benzimidazol-2-yl)pyrimidines--a multikinase inhibitor scaffold with antiproliferative activity toward cancer cell lines.

description: Small molecule binding data for protein AKT/p21CIP1, Aurora kinase B/Inner centromere protein, Focal adhesion kinase 1/vascular endothelial growth factor receptor 3, Serine/threonine-protein kinase PLK1, and Vascular endothelial growth factor receptor 2, Uniprot P31749, P35968, P53350, Q05397, and Q96GD4
DOI: 10.7270/q2zw1mwr
title: BindingDB Entry 50039039: 5-OMe-UDP is a potent and selective P2Y(6)-receptor agonist.

description: Small molecule binding data for protein Purinergic receptor P2Y2, Pyrimidinergic receptor P2Y4, and Pyrimidinergic receptor P2Y6, Uniprot P35383, P41231, P51582, Q15077, and Q63371
DOI: 10.7270/q200034n
title: BindingDB Entry 50039861: Synthesis and evaluation of boronic acids as inhibitors of Penicillin Binding Proteins of classes A, B and C.

description: Small molecule binding data for protein D-alanyl-D-alanine carboxypeptidase and Penicillin-binding protein 2X, Uniprot P39045 and P59676
DOI: 10.7270/q2125tdt
title: BindingDB Entry 50037179: Structure-activity relationships of novel cyclic alpha-MSH/beta-MSH hybrid analogues that lead to potent and selective ligands for the human MC3R and human MC5R.

description: Small molecule binding data for protein Melanocortin receptor 3 (MC3R), Melanocortin receptor 4, and Melanocortin receptor 5 (MC5R), Uniprot P32245, P33032, and P41968
DOI: 10.7270/q22n5372
title: BindingDB Entry 50039046: Studies of benzothiophene template as potent factor IXa (FIXa) inhibitors in thrombosis.

description: Small molecule binding data for protein Coagulation factor IX and X, Coagulation factor X/antithrombin III, and Urokinase-type plasminogen activator, Uniprot P00740, P00742, and P00749
DOI: 10.7270/q23779jh
title: BindingDB Entry 50038127: Synthesis and evaluation of novel 3,4,6-substituted 2-quinolones as FMS kinase inhibitors.

description: Small molecule binding data for protein Macrophage colony stimulating factor receptor, Platelet-derived growth factor receptor beta, Tyrosine-protein kinase Kit (Kit), and Tyrosine-protein kinase receptor FLT3, Uniprot P07333, P09619, P10721, and P36888
DOI: 10.7270/q23r0twq
title: BindingDB Entry 50039860: Microwave assisted synthesis of spirocyclic pyrrolidines -s1 receptor ligands with modified benzene-N-distance.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 6 (5-HT6), 5-Hydroxytryptamine receptor 7 (5-HT7), and Sigma-1 receptor, Uniprot P34969, P50406, and Q60492
DOI: 10.7270/q26d5txj
title: BindingDB Entry 50039045: Engineering galanin analogues that discriminate between GalR1 and GalR2 receptor subtypes and exhibit anticonvulsant activity following systemic delivery.

description: Small molecule binding data for protein GALR1 and Galanin receptor 2, Uniprot O08726, O43603, and P47211
DOI: 10.7270/q2708287
title: BindingDB Entry 50038126: Novel ketooxazole based inhibitors of fatty acid amide hydrolase (FAAH).

description: Small molecule binding data for protein Fatty-acid amide hydrolase 1 (FAAH), Uniprot O00519
DOI: 10.7270/q27d2w64
title: BindingDB Entry 50039859: Synthesis and evaluation of 4- and 5-pyridazin-3-one phenoxypropylamine analogues as histamine-3 receptor antagonists.

description: Small molecule binding data for protein Cytochrome P450 1A, Cytochrome P450 2C19, Cytochrome P450 2C9, Cytochrome P450 2D6 (2D6), Cytochrome P450 3A, Histamine H1 receptor, Histamine H2 Receptor, Histamine H3 receptor, Histamine receptor (H3), Histamine receptor (H4), and Voltage-gated potassium channel, Uniprot P05177, P08684, P10635, P11712, P25021, P33261, P35367, Q12809, Q9H3N8, Q9QYN8, and Q9Y5N1
DOI: 10.7270/q28k79t3
title: BindingDB Entry 50037177: Efficacious and orally bioavailable thrombin inhibitors based on a 2,5-thienylamidine at the P1 position: discovery of N-carboxymethyl-d-diphenylalanyl-l-prolyl[(5-amidino-2-thienyl)methyl]amide.

description: Small molecule binding data for protein Coagulation factor X/antithrombin III, Plasminogen, Prothrombin, Tissue-type plasminogen activator, Trypsin, and Trypsin II, Uniprot P00734, P00742, P00747, P00750, P00760, P07477, and P07478
DOI: 10.7270/q2b56kpq
title: BindingDB Entry 50039044: Synthesis, structure-activity relationship and crystallographic studies of 3-substituted indolin-2-one RET inhibitors.

description: Small molecule binding data for protein ALK tyrosine kinase receptor, Kinesin-1 heavy chain/ Tyrosine-protein kinase receptor RET, Tyrosine-protein kinase ABL1, and Tyrosine-protein kinase receptor FLT3, Uniprot P00519, P07949, P36888, and Q9UM73
DOI: 10.7270/q2c53mw0
title: BindingDB Entry 50039858: Thieno[3,2-b]thiophene-2-carboxylic acid derivatives as GPR35 agonists.

description: Small molecule binding data for protein G-protein coupled receptor 35, Uniprot Q9HC97
DOI: 10.7270/q2d79c5z
title: BindingDB Entry 50037176: Structure-activity relationships in carboxamide derivatives based on the targeted delivery of radionuclides and boron atoms by means of peripheral benzodiazepine receptor ligands.

description: Small molecule binding data for protein Peripheral-Type Benzodiazepine Receptor, Uniprot P16257
DOI: 10.7270/q2fj2hnn
title: BindingDB Entry 50038132: Cyclic guanidines as dual 5-HT5A/5-HT7 receptor ligands: optimising brain penetration.

description: Small molecule binding data for protein 5-Hydroxytryptamine receptor 2A (5-HT2A), 5-Hydroxytryptamine receptor 2C (5-HT2C), 5-Hydroxytryptamine receptor 6 (5-HT6), 5-Hydroxytryptamine receptor 7 (5-HT7), 5-hydroxytryptamine receptor 1A, 5-hydroxytryptamine receptor 1D, HTR5A, Histamine H1 receptor, Serotonin (5-HT) receptor, and Serotonin 3 (5-HT3) receptor, Uniprot P08908, P28221, P28223, P28335, P34969, P35364, P35367, P46098, P47898, and P50406
DOI: 10.7270/q2fx7bd4
title: BindingDB Entry 50039043: Subtlety of the structure-affinity and structure-efficacy relationships around a nonpeptide oxytocin receptor agonist.

description: Small molecule binding data for protein Oxytocin receptor, Vasopressin V1a receptor (V1a), and Vasopressin V2 receptor (V2), Uniprot P30518, P30559, and P37288
DOI: 10.7270/q2gx4cmd
title: BindingDB Entry 50039857: Pyrazole[3,4-e][1,4]thiazepin-7-one derivatives as a novel class of Farnesoid X Receptor (FXR) agonists.

description: Small molecule binding data for protein Bile acid receptor FXR, Uniprot Q96RI1
DOI: 10.7270/q2j103wt
title: BindingDB Entry 50037175: Antimalarial drug quinacrine binds to C-terminal helix of cellular prion protein.

description: Small molecule binding data for protein Prion protein, Uniprot P04156
DOI: 10.7270/q2kp834v
title: BindingDB Entry 50039042: Binding of curcumin and its long chain derivatives to the activator binding domain of novel protein kinase C.

description: Small molecule binding data for protein Protein kinase C delta type, Protein kinase C theta type, and Protein kinase C, epsilon, Uniprot Q02156, Q04759, and Q05655
DOI: 10.7270/q2m909hr
title: BindingDB Entry 50038123: Potent, selective MCH-1 receptor antagonists.

description: Small molecule binding data for protein Melanin-concentrating hormone receptor and Mu-type opioid receptor, Uniprot P35372 and Q99705
DOI: 10.7270/q2mp54b4
title: BindingDB Entry 50039856: Activity landscape modeling of PPAR ligands with dual-activity difference maps.

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/q2ns0vn9
title: BindingDB Entry 50037174: Autoradiographic visualization of corticotropin releasing hormone type 1 receptors with a nonpeptide ligand: synthesis of [(76)Br]MJL-1-109-2.

description: Small molecule binding data for protein Corticotropin releasing factor receptor, Uniprot P35353
DOI: 10.7270/q2q24133
title: BindingDB Entry 50038130: Novel GSK-3beta inhibitors from sequential virtual screening.

description: Small molecule binding data for protein Glycogen synthase kinase-3, Uniprot P49841
DOI: 10.7270/q2qf8ttb
title: BindingDB Entry 50039041: Semi-synthetic aristolactams--inhibitors of CDK2 enzyme.

description: Small molecule binding data for protein AKT/p21CIP1, Cyclin-dependent kinase 1, Cyclin-dependent kinase 2, Cyclin-dependent kinase 4, and Serine/threonine-protein kinase Aurora, Uniprot O14965, P06493, P11802, P24941, and P31749
DOI: 10.7270/q2rf5w3x
title: BindingDB Entry 50039855: Radiosynthesis of a¹8F-labeled 2,3-diarylsubstituted indole via McMurry coupling for functional characterization of cyclooxygenase-2 (COX-2) in vitro and in vivo.

description: Small molecule binding data for protein Cyclooxygenase and Prostaglandin G/H synthase (cyclooxygenase), Uniprot P05979 and P35354
DOI: 10.15468/dl.h4sqp7
title: Occurrence Download

description: A dataset containing 25 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Osteospermum calcicola (J.C.Manning & Goldblatt) J.C.Manning & Goldblatt"
 ]
}

 The dataset includes 25 records from 6 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0066433-240321170329656/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.uz9vp8
title: Occurrence Download

description: A dataset containing 71 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Paeonia ludlowii (Stern & G.Taylor) D.Y.Hong"
 ]
}

 The dataset includes 71 records from 18 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0066432-240321170329656/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.g4wn9y
title: Occurrence Download

description: A dataset containing 173 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Passiflora wilsonii Hemsl."
 ]
}

 The dataset includes 173 records from 23 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0066435-240321170329656/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.srfw8s
title: Occurrence Download

description: A dataset containing 5378 species occurrences available in GBIF matching the query:
{
 "and" : [
 "OccurrenceStatus is Present",
 "TaxonKey is Ochotona princeps (Richardson, 1828)",
 "Year 1849-1980"
 ]
}

 The dataset includes 5378 records from 74 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0066434-240321170329656/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.z2jszd
title: Occurrence Download

description: A dataset containing 17 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Oxalis crispula Sond."
 ]
}

 The dataset includes 17 records from 4 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0066436-240321170329656/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.tu8j4g
title: Occurrence Download

description: A dataset containing 312 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Papaver laevigatum M.Bieb."
 ]
}

 The dataset includes 312 records from 46 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0066437-240321170329656/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.5281/zenodo.10899843
title: Data for "A Fast-Charging Study on the Lifetime of Power-Optimized Lithium Titanite Batteries By Electrochemical Impedance Spectroscopy"
DOI: 10.5281/zenodo.10899844
title: Data for "A Fast-Charging Study on the Lifetime of Power-Optimized Lithium Titanite Batteries By Electrochemical Impedance Spectroscopy"
DOI: 10.15468/dl.yz5f5j
title: Occurrence Download

description: A dataset containing 422 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Osteospermum calendulaceum L.fil."
 ]
}

 The dataset includes 422 records from 32 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0066438-240321170329656/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.tw9qzt
title: Occurrence Download

description: A dataset containing 227 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Paeonia mairei H.Lév."
 ]
}

 The dataset includes 227 records from 24 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0066439-240321170329656/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.c6qbsh
title: Occurrence Download

description: A dataset containing 218102 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Cirsium oleraceum (L.) Scop."
 ]
}

 The dataset includes 218102 records from 628 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0066418-240321170329656/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.erhq3q
title: Occurrence Download

description: A dataset containing 20 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Passiflora xishuangbannaensis Krosnick"
 ]
}

 The dataset includes 20 records from 9 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0066440-240321170329656/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.trj3uv
title: Occurrence Download

description: A dataset containing 25 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Oxalis crocea T.M.Salter"
 ]
}

 The dataset includes 25 records from 5 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0066441-240321170329656/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.qdmfr4
title: Occurrence Download

description: A dataset containing 215095 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Moehringia trinervia (L.) Clairv."
 ]
}

 The dataset includes 215095 records from 1197 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0066424-240321170329656/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.6084/m9.figshare.22655423.v1
title: Additional file 9 of Identification of genetic variants that impact gene co-expression relationships using large-scale single-cell data

description: Additional file 9: Table S14. GO enrichment for co-eGenes associated with the same eQTL, for all eQTLs with at least 5 co-eGenes
DOI: 10.6084/m9.figshare.22655432.v1
title: Additional file 12 of Identification of genetic variants that impact gene co-expression relationships using large-scale single-cell data

description: Additional file 12: Table S17. Enrichment of co-eGenes for GWAS results
DOI: 10.6084/m9.figshare.20038731.v1
title: Simultaneous estimation of rosuvastatin and amlodipine in pharmaceutical formulations using stability indicating HPLC method

description: A viable cost-effective and isocratic approach employing C-18 column (250 mm × 4.6 mm, 5 µm) based HPLC has been utilized to separate and estimate the drugs, rosuvastatin, amlodipine and their stress induced degradation products, simultaneously in pharmaceutical formulations. Focused on ICH guideline parameters, the efficient separation of both drugs and their degradation products was achieved by optimizing a 30:70 (v/v) solvent mixture of acetonitrile and 0.1 M ammonium acetate buffer (pH 5) as mobile phase. The flow rate of the mobile phase was 1.5 mL/min and all the detections were carried out at 240 nm using UV detector. The method was linear in the concentration range of 1-200 µg/mL for rosuvastatin with 0.996 coefficient of determination value. For amlodipine, linearity was in the range of 0.5-100 µg/ml with 0.994 coefficient of determination value. Both the drugs along with their degradation products were separated in less than twenty minutes. The results of within-day and between-day precision were varied from 0.72 to 1.81% for rosuvastatin and 0.83 to 1.88% for amlodipine. The results show that this ICH validated method can be employed successfully for the routine as well as stability quantification of both the active ingredients simultaneously in pharmaceutical formulations.
DOI: 10.6084/m9.figshare.14266765.v1
title: Additional file 3 of Revealing taxon-specific heavy metal-resistance mechanisms in denitrifying phosphorus removal sludge using genome-centric metaproteomics

description: Additional file 2: Supplementary dataset. The quality metrics, taxonomy, and abundance of MAGs.
DOI: 10.6084/m9.figshare.7461734.v1
title: D-CCA: A Decomposition-based Canonical Correlation Analysis for High-Dimensional Datasets<sup>*</sup>

description: A typical approach to the joint analysis of two high-dimensional datasets is to decompose each data matrix into three parts: a low-rank common matrix that captures the shared information across datasets, a low-rank distinctive matrix that characterizes the individual information within a single dataset, and an additive noise matrix. Existing decomposition methods often focus on the orthogonality between the common and distinctive matrices, but inadequately consider the more necessary orthogonal relationship between the two distinctive matrices. The latter guarantees that no more shared information is extractable from the distinctive matrices. We propose decomposition-based canonical correlation analysis (D-CCA), a novel decomposition method that defines the common and distinctive matrices from the ℒ2 space of random variables rather than the conventionally used Euclidean space, with a careful construction of the orthogonal relationship between distinctive matrices. D-CCA represents a natural generalization of the traditional canonical correlation analysis. The proposed estimators of common and distinctive matrices are shown to be consistent and have reasonably better performance than some state-of-the-art methods in both simulated data and the real data analysis of breast cancer data obtained from The Cancer Genome Atlas.
DOI: 10.6084/m9.figshare.20038719.v1
title: Reduced bioavailability of cyclosporine A in rats by mung bean seed coat extract

description: Mung bean seed coat (MBSC) is a healthcare product in Asian countries. The aim of this study was to investigate the effect of an MBSC ethanol extract on the bioavailability of cyclosporine A (CsA) in rats. Rats were orally dosed with CsA alone or in combination with MBSC ethanol extracts (500 mg/kg, p.o.). The blood levels of CsA were assayed by liquid chromatography with an electrospray ionization source and tandem mass spectrometry (LC-MS/MS). The everted rat intestinal sac technique was used to determine the influence of MBSC on the absorption of CsA. The results reveal that combined CsA intake with MBSC decreased the Cmax, AUC0-t, t1/2z and MRT0-t values of CsA by 24.96%, 47.28%, 34.73% and 23.58%, respectively (P&lt;0.05), and significantly raised the CL/F by 51.97% (P&lt;0.01). The in vitro results demonstrated that significantly less CsA was absorbed (P&lt;0.05). The overall results indicate that after being concomitantly ingested, MBSC reduced the bioavailability of CsA, at least partially, in the absorption phase.
DOI: 10.6084/m9.figshare.14266768.v1
title: Additional file 4 of Revealing taxon-specific heavy metal-resistance mechanisms in denitrifying phosphorus removal sludge using genome-centric metaproteomics

description: Additional file 3: Supplementary dataset. The functional annotation, differential expression profile, and potential producer (represented by MAG) of label-free quantified proteins.
DOI: 10.6084/m9.figshare.19514451.v2
title: Managing retrial queueing systems with boundedly rational customers

description: Bounded rationality includes potential cognitive deficits that limit human rational behaviour. In this paper, we allow for estimation errors of their utility and consider bounded rationality in queueing models with retrials. Upon arrival, customers decide whether to join the system based on their perceived utility, and their choice behaviour is characterised by a logit choice model. For a revenue-seeking server and a social planner, we investigate corresponding optimal pricing strategies. We find that the revenue-optimal price is no longer socially efficient in general but depends on the retrial rate. There exists a threshold such that the socially optimal price is greater than the revenue-optimal one when the retrial rate is below this threshold; otherwise, the revenue-optimal price is greater. A larger bounded rationality widens the gap between social welfare under the revenue- and socially optimal prices. Furthermore, the server’s revenue may increase or first decrease and then increase with respect to customers’ rationality levels, and the server may find it beneficial to reveal waiting time information when customers’ rationality is high. Finally, failing to account for customers’ bounded rationality can lead a significant revenue loss for the server and the proportion of such a revenue loss is close to 1 as customers become fully boundedly rational.