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What is CovalentInDB
CovalentInDB (Covalent Inhibitor Database) is the largest web-accessible
resource for covalent inhibitors
and related targets. The
latest version provides the information for 4806 covalent inhibitors and 298
related protein
targets collected by comprehensive literature searching. The inhibitors in CovlnDB possess
57
types of reactive warheads, including Michael acceptor, beta lactam, boronic acid,
epoxide, halohydrocarbon, etc.
CovalentInDB provides not only the basic information of covalent inhibitors, targets, and
bioactivity, but also the reactive warheads of inhibitors, covalent reaction mechanism,
attacked
nucleophilic residues and covalent-mechanism
experimental verification methods. A molecular
visualization function is also embedded to display protein-ligand interaction.
Moreover, CovalentInDB
also provides the structural transformation process during the covalent reaction
for each
warhead.
News:
2021/05/23: Dear users, we updated CovalentInDB
recently. The information for 295 covalent inhibitors
and 18 targets was added. The data for crystal structures of proteins bound with
covalent inhibitors is on the way.
2021/05/23: Dear users, we updated CovalentInDB
recently. The information for 295 covalent inhibitors
and 18 targets was added. The data for crystal structures of proteins bound with
covalent inhibitors is on the way.
