cometadata/datacite-titles-descriptions-related-identifiers huggingface dataset:
DOI: 10.6084/m9.figshare.29436136.v1
title: Discovery and evaluation of novel pyrrole/thiophene chalcone urea EGFR inhibitors via biological and docking studies

description: This study aimed to synthesize novel chalcone-urea derivatives and evaluate their anticancer potential through antiproliferative, apoptotic, and epidermal growth factor receptor (EGFR) inhibitory activities, supported by molecular modeling. Thirty-three chalcone-urea derivatives were synthesized in two series: pyrrole-chalcone ureas (<b>4a</b>–<b>4r</b>) and thiophene-chalcone ureas (<b>5a</b>–<b>5p</b>). Compounds were characterized using<sup>1</sup> H NMR, <sup>13</sup> C NMR, and mass spectrometry. Their antiproliferative effects were assessed against renal adenocarcinoma (769P), lung carcinoma (A549), colorectal adenocarcinoma (HT-29), and healthy kidney (HEK-293) cell lines. Selected compounds were further evaluated for EGFR inhibition, apoptotic activity, and cell cycle arrest. Molecular docking was performed to predict binding interactions with wild-type human EGFR. Compounds <b>4e</b>, <b>4f</b>, and <b>4g</b> (pyrrole series) showed strong cytotoxicity against A549 and HT-29, while <b>5b</b>, <b>5c</b>, and <b>5d</b> (thiophene series) were effective on 769P. Compound <b>5c</b> exhibited the highest EGFR inhibition (IC₅₀ = 1 nM), potent apoptotic induction, and cell cycle arrest at the S phase in A549 cells. Docking studies confirmed favorable binding of <b>4r</b>, <b>5c</b>, and <b>5d</b> within the EGFR active site. Several chalcone-urea derivatives demonstrated potent anticancer properties, with compound 5c emerging as a promising EGFR inhibitor with strong cytotoxic and pro-apoptotic effects.
DOI: 10.6084/m9.figshare.29477027
title: Synthesis, antiproliferative evaluation and <i>in silico</i> studies of new quinazoline derivatives as VEGFR-2 inhibitors

description: New quinazoline derivatives were designed and synthesized to target VEGFR-2, aiming to identify potential anticancer agents. The synthesized compounds underwent <i>in</i> <i>vitro</i> screening to evaluate their cytotoxic effects across 60 cancer cells following the NCI protocol. The most promising derivatives, <b>3i</b> and <b>3j</b>, underwent further evaluation <i>via</i> a five-dose test to assess broad-spectrum anticancer activity. Their VEGFR-2 inhibitory potential was compared to sorafenib. Cell cycle analyses, annexin V-FITC, and apoptotic markers were used to examine HT-29 colon cancer cells after treatment with <b>3j</b> for cell cycle arrest and apoptosis induction. Molecular docking and MD simulations explored binding interactions, while ADMET studies assessed pharmacokinetics. Compounds <b>3i</b> and <b>3j</b> exhibited potent to moderate cytotoxic activity, with compound <b>3j</b> showing the highest activity against colon cancer cell lines (GI<sub>50</sub> = 3.29 μM). Both compounds demonstrated promising VEGFR-2 inhibitory activity (IC<sub>50</sub> = 0.120 and 0.197 µM, respectively), comparable to sorafenib (IC<sub>50</sub> = 0.088 µM). Cell cycle analysis displayed G1 phase arrest and pro-apoptotic effects. Docking studies confirmed favorable VEGFR-2 binding affinity (−7.57 and −7.83 kcal/mol). ADMET profiling indicated promising drug-like properties. Compounds <b>3i</b> and <b>3j</b> exhibit promising VEGFR-2 inhibitory properties and significant anticancer activity, warranting further investigation.
DOI: 10.6084/m9.figshare.29477027.v1
title: SynthesIs, antiproliferative evaluation and <i>in silico</i> studies of new quinazoline derivatives as VEGFR-2 inhibitors

description: New quinazoline derivatives were designed and synthesized to target VEGFR-2, aiming to identify potential anticancer agents. The synthesized compounds underwent <i>in</i> <i>vitro</i> screening to evaluate their cytotoxic effects across 60 cancer cells following the NCI protocol. The most promising derivatives, <b>3i</b> and <b>3j</b>, underwent further evaluation <i>via</i> a five-dose test to assess broad-spectrum anticancer activity. Their VEGFR-2 inhibitory potential was compared to sorafenib. Cell cycle analyses, annexin V-FITC, and apoptotic markers were used to examine HT-29 colon cancer cells after treatment with <b>3j</b> for cell cycle arrest and apoptosis induction. Molecular docking and MD simulations explored binding interactions, while ADMET studies assessed pharmacokinetics. Compounds <b>3i</b> and <b>3j</b> exhibited potent to moderate cytotoxic activity, with compound <b>3j</b> showing the highest activity against colon cancer cell lines (GI<sub>50</sub> = 3.29 μM). Both compounds demonstrated promising VEGFR-2 inhibitory activity (IC<sub>50</sub> = 0.120 and 0.197 µM, respectively), comparable to sorafenib (IC<sub>50</sub> = 0.088 µM). Cell cycle analysis displayed G1 phase arrest and pro-apoptotic effects. Docking studies confirmed favorable VEGFR-2 binding affinity (−7.57 and −7.83 kcal/mol). ADMET profiling indicated promising drug-like properties. Compounds <b>3i</b> and <b>3j</b> exhibit promising VEGFR-2 inhibitory properties and significant anticancer activity, warranting further investigation.
DOI: 10.6084/m9.figshare.29477027.v2
title: Synthesis, antiproliferative evaluation and <i>in silico</i> studies of new quinazoline derivatives as VEGFR-2 inhibitors

description: New quinazoline derivatives were designed and synthesized to target VEGFR-2, aiming to identify potential anticancer agents. The synthesized compounds underwent <i>in</i> <i>vitro</i> screening to evaluate their cytotoxic effects across 60 cancer cells following the NCI protocol. The most promising derivatives, <b>3i</b> and <b>3j</b>, underwent further evaluation <i>via</i> a five-dose test to assess broad-spectrum anticancer activity. Their VEGFR-2 inhibitory potential was compared to sorafenib. Cell cycle analyses, annexin V-FITC, and apoptotic markers were used to examine HT-29 colon cancer cells after treatment with <b>3j</b> for cell cycle arrest and apoptosis induction. Molecular docking and MD simulations explored binding interactions, while ADMET studies assessed pharmacokinetics. Compounds <b>3i</b> and <b>3j</b> exhibited potent to moderate cytotoxic activity, with compound <b>3j</b> showing the highest activity against colon cancer cell lines (GI<sub>50</sub> = 3.29 μM). Both compounds demonstrated promising VEGFR-2 inhibitory activity (IC<sub>50</sub> = 0.120 and 0.197 µM, respectively), comparable to sorafenib (IC<sub>50</sub> = 0.088 µM). Cell cycle analysis displayed G1 phase arrest and pro-apoptotic effects. Docking studies confirmed favorable VEGFR-2 binding affinity (−7.57 and −7.83 kcal/mol). ADMET profiling indicated promising drug-like properties. Compounds <b>3i</b> and <b>3j</b> exhibit promising VEGFR-2 inhibitory properties and significant anticancer activity, warranting further investigation.
DOI: 10.15468/dl.uv4sf7
title: Occurrence Download

description: A dataset containing 15 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is one of (Nannocharax taenia)",
 "BasisOfRecord is one of (Specimen, Literature Occurrence, Human Observation, Observation)",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "Year is greater than or equal to 1991",
 "Year is less than or equal to 2025"
 ]
}

 The dataset includes 15 records from 2 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0040470-250717081556266/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.mut27t
title: Occurrence Download

description: A dataset containing 0 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Tagetes minuta",
 "Country is North Macedonia",
 "HasCoordinate is true"
 ]
}

 The dataset includes 0 records from 0 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0040472-250717081556266/datasets/export for details.
DOI: 10.15468/dl.v8q3ne
title: Occurrence Download

description: A dataset containing 0 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Cuscuta pentagona",
 "Country is Kiribati",
 "HasCoordinate is true"
 ]
}

 The dataset includes 0 records from 0 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0040474-250717081556266/datasets/export for details.
DOI: 10.15468/dl.7q98v9
title: Occurrence Download

description: A dataset containing 68 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Tagetes minuta",
 "Country is Portugal",
 "HasCoordinate is true"
 ]
}

 The dataset includes 68 records from 2 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0040473-250717081556266/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.9v68fa
title: Occurrence Download

description: A dataset containing 273 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Nothoscordum bonariense"
 ]
}

 The dataset includes 273 records from 50 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0040475-250717081556266/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.pa93ah
title: Occurrence Download

description: A dataset containing 0 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Neosiphonia harveyi",
 "Country is Sweden",
 "HasCoordinate is true"
 ]
}

 The dataset includes 0 records from 0 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0040476-250717081556266/datasets/export for details.
DOI: 10.15468/dl.hhdkhf
title: Occurrence Download

description: A dataset containing 921 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Swertia angustifolia"
 ]
}

 The dataset includes 921 records from 50 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0040477-250717081556266/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.s8ty66
title: Occurrence Download

description: A dataset containing 1 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Parthenium hysterophorus",
 "Country is Rwanda",
 "HasCoordinate is true"
 ]
}

 The dataset includes 1 records from 1 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0040478-250717081556266/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.x94h95
title: Occurrence Download

description: A dataset containing 0 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Cuscuta pentagona",
 "Country is Kyrgyzstan",
 "HasCoordinate is true"
 ]
}

 The dataset includes 0 records from 0 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0040479-250717081556266/datasets/export for details.
DOI: 10.15468/dl.ysdvdw
title: Occurrence Download

description: A dataset containing 110136 species occurrences available in GBIF matching the query:
{
 "and" : [
 "HasCoordinate is true",
 "TaxonKey is Hippophae rhamnoides"
 ]
}

 The dataset includes 110136 records from 573 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0040379-250717081556266/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.t3pyq2
title: Occurrence Download

description: A dataset containing 37 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Pyralis regalis (Denis & Schiffermüller), 1775",
 "HasCoordinate is true",
 "Country is Japan",
 "HasGeospatialIssue is false"
 ]
}

 The dataset includes 37 records from 10 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0189495-220831081235567/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.6z5wdq
title: Occurrence Download

description: A dataset containing 464400 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Delichon urbicum (Linnaeus, 1758)",
 "DatasetKey is EOD – eBird Observation Dataset",
 "Country is one of (Germany, France, Spain, Portugal, Denmark, Austria, Italy, Switzerland, Greece, Poland, Hungary, Slovenia, Sweden, Norway, Slovakia, Montenegro, Croatia, North Macedonia, Serbia, Iceland, Ireland, United Kingdom of Great Britain and Northern Ireland, Albania, Bosnia and Herzegovina, Bulgaria, Belgium, Netherlands)"
 ]
}

 The dataset includes 464400 records from 1 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0168557-220831081235567/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.gnrndw
title: Occurrence Download

description: A dataset containing 738 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Xylodromus concinnus (Marsham, 1802)"
 ]
}

 The dataset includes 738 records from 74 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0265951-220831081235567/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.pqtu5k
title: Occurrence Download

description: A dataset containing 65549 species occurrences available in GBIF matching the query:
{
 "and" : [
 "OccurrenceStatus is Present",
 "TaxonKey is Carex pulicaris L."
 ]
}

 The dataset includes 65549 records from 472 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0200214-220831081235567/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.7sy2mq
title: Occurrence Download

description: A dataset containing 1660 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Fraxinus sieboldiana Blume",
 "HasCoordinate is true",
 "Country is Japan",
 "HasGeospatialIssue is false"
 ]
}

 The dataset includes 1660 records from 45 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0189511-220831081235567/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.g42mt9
title: Occurrence Download

description: A dataset containing 154 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Euchresta japonica Hook.f. ex Regel",
 "HasCoordinate is true",
 "HasGeospatialIssue is false"
 ]
}

 The dataset includes 154 records from 20 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0264125-220831081235567/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.m4d2x5
title: Occurrence Download

description: A dataset containing 19 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Syringa vulgaris L.",
 "HasCoordinate is true",
 "Country is Japan",
 "HasGeospatialIssue is false"
 ]
}

 The dataset includes 19 records from 9 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0189519-220831081235567/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.by3yt8
title: Occurrence Download

description: A dataset containing 58 species occurrences available in GBIF matching the query:
{
 "and" : [
 "TaxonKey is Arisaema nikoense subsp. nikoense",
 "HasCoordinate is true",
 "Country is Japan",
 "HasGeospatialIssue is false"
 ]
}

 The dataset includes 58 records from 6 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0200217-220831081235567/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.kypj26
title: Occurrence Download

description: A dataset containing 22100 species occurrences available in GBIF matching the query:
{
 "and" : [
 "Country is France",
 "TaxonKey is Mustela erminea Linnaeus, 1758"
 ]
}

 The dataset includes 22100 records from 193 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0168963-220831081235567/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.nh4qs9
title: Occurrence Download

description: A dataset containing 102495 species occurrences available in GBIF matching the query:
{
 "TaxonKey" : [
 "is Anagallis arvensis L."
 ]
}

 The dataset includes 102495 records from 966 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0172370-220831081235567/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.u94syr
title: Occurrence Download

description: A dataset containing 2518 species occurrences available in GBIF matching the query:
{
 "and" : [
 "Country is Mexico",
 "HasCoordinate is true",
 "HasGeospatialIssue is false",
 "TaxonKey is Ateles geoffroyi vellerosus"
 ]
}

 The dataset includes 2518 records from 20 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0011546-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.15468/dl.xkpfwh
title: Occurrence Download

description: A dataset containing 12356 species occurrences available in GBIF matching the query:
{
 "and" : [
 "BasisOfRecord is one of (Specimen)",
 "TaxonKey is one of (Lithobates catesbeianus)",
 "Country is one of (United States of America, Canada, Mexico)",
 "Year is greater than or equal to 1979"
 ]
}

 The dataset includes 12356 records from 76 constituent datasets; see https://api.gbif.org/v1/occurrence/download/0011547-251009101135966/datasets/export for details.
 
Data from some individual datasets included in this download may be licensed under less restrictive terms.
DOI: 10.60712/si-id332708.1
title: StrainInfo SI-ID 332708.1

description: StrainInfo dataset 332708 about a strain of Sordaria fimicola. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332709.1
title: StrainInfo SI-ID 332709.1

description: StrainInfo dataset 332709 about a strain of Sordaria fimicola. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332791.1
title: StrainInfo SI-ID 332791.1

description: StrainInfo dataset 332791 about a strain of Aspergillus nidulans. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332792.1
title: StrainInfo SI-ID 332792.1

description: StrainInfo dataset 332792 about a strain of Aspergillus nidulans. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332793.1
title: StrainInfo SI-ID 332793.1

description: StrainInfo dataset 332793 about a strain of Aspergillus nidulans. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332637.1
title: StrainInfo SI-ID 332637.1

description: StrainInfo dataset 332637 about a strain of Sordaria fimicola. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332638.1
title: StrainInfo SI-ID 332638.1

description: StrainInfo dataset 332638 about a strain of Sordaria fimicola. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332639.1
title: StrainInfo SI-ID 332639.1

description: StrainInfo dataset 332639 about a strain of Sordaria fimicola. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332640.1
title: StrainInfo SI-ID 332640.1

description: StrainInfo dataset 332640 about a strain of Sordaria fimicola. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332710.1
title: StrainInfo SI-ID 332710.1

description: StrainInfo dataset 332710 about a strain of Sordaria fimicola. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332711.1
title: StrainInfo SI-ID 332711.1

description: StrainInfo dataset 332711 about a strain of Sordaria fimicola. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332712.1
title: StrainInfo SI-ID 332712.1

description: StrainInfo dataset 332712 about a strain of Sordaria fimicola. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332713.1
title: StrainInfo SI-ID 332713.1

description: StrainInfo dataset 332713 about a strain of Sordaria fimicola. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332794.1
title: StrainInfo SI-ID 332794.1

description: StrainInfo dataset 332794 about a strain of Neurospora crassa. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.
DOI: 10.60712/si-id332795.1
title: StrainInfo SI-ID 332795.1

description: StrainInfo dataset 332795 about a strain of Neurospora crassa. StrainInfo is a service developed to provide a resolution of microbial strain identifiers by storing culture collection numbers, their relations, and culture-associated data. StrainInfo is part of NFDI4Microbiota consortium.