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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00021617

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ACHACETYLCHOLINEA,B2RIN0.86
ACHACETYLCHOLINEA,B2HA40.86
ACHACETYLCHOLINEA2ACE0.86
ACHACETYLCHOLINEA,B,C,D,E,F2J0H0.86
DMGN,N-DIMETHYLGLYCINEA,B,C,D1VRQ0.85
DMGN,N-DIMETHYLGLYCINEA,B,C,D1X310.85
DMGN,N-DIMETHYLGLYCINEA,B,C1XKP0.85
DMGN,N-DIMETHYLGLYCINEA,B1EL50.85
BETTRIMETHYL GLYCINEA1RCC0.85
BETTRIMETHYL GLYCINEA,B3DSB0.85
BETTRIMETHYL GLYCINEA1RCI0.85
BETTRIMETHYL GLYCINEA1SW20.85
BETTRIMETHYL GLYCINEA1RCE0.85
BETTRIMETHYL GLYCINEA1R9L0.85
BETTRIMETHYL GLYCINEA1RCD0.85
BETTRIMETHYL GLYCINEA,B,C2WIT0.85
BETTRIMETHYL GLYCINEA2B4L0.85
BETTRIMETHYL GLYCINEA1RCG0.85
BETTRIMETHYL GLYCINEA,B,C,D1WWJ0.85
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA,B1U6R0.71
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA1RL90.71
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA,B1VRP0.71
CCE2-[(AMINOCARBONYL)OXY]-N,N,N-TRIMETHYLETHANAMINIUMC,D,J1UV60.72
BCNBICINEA,B,C,D2V8H0.76
BCNBICINEA1QUS0.76
BCNBICINEA1LTM0.76
BCNBICINEA2JC50.76
BCNBICINEA,B,C,D1V0J0.76
BCNBICINEA1QDR0.76
BCNBICINEA1KI00.76
BCNBICINEY,Z1KMI0.76
BCNBICINEA,B,C2OV50.76
BCNBICINEA2A810.76
BCNBICINEA,B,C,D2V8G0.76
BCNBICINEA,B3HWR0.76
BCNBICINEA2R6S0.76
BCNBICINEA,B2R4J0.76
NTANITRILOTRIACETIC ACIDA1GVC0.78
NTANITRILOTRIACETIC ACIDA1NFT0.78
LALN,N-DIMETHYL-L-ALANINEA,B1R1G0.74