AncPhore: A versatile tool for anchor pharmacophore steered drug discovery with applications in discovery of new inhibitors targeting metallo-

Qingqing DAI; Yuhang YAN; Xiangli NING; Gen LI; Junlin YU; Ji DENG; Lingling YANG; Guo-Bo LI

Qingqing DAI; Yuhang YAN; Xiangli NING; Gen LI; Junlin YU; Ji DENG; Lingling YANG; Guo-Bo LI.

Acta Pharmaceutica Sinica B ; (6): 1931-1946, 2021.

Article in English | WPRIM | ID: wpr-888843

ABSTRACT

ABSTRACT

We herein describe AncPhore, a versatile tool for drug discovery, which is characterized by pharmacophore feature analysis and anchor pharmacophore (

AMPC, asian mouse phenotyping consortium; AP, anchor pharmacophore; AR, aromatic ring; AUC, area under the curve; Anchor pharmacophore

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Full text: Available Index: WPRIM (Western Pacific) Type of study: Prognostic study Language: English Journal: Acta Pharmaceutica Sinica B Year: 2021 Type: Article

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Full text: Available Index: WPRIM (Western Pacific) Type of study: Prognostic study Language: English Journal: Acta Pharmaceutica Sinica B Year: 2021 Type: Article