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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03281214

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1ALALLANTOATE IONA,B,D,E,F,G,H2YZC0.78
1ALALLANTOATE IONA,B1Z2L0.78
EDT{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-
CARBOXYMETHYL-AMINO}-ACETIC ACID
A2AXN0.72
EDT{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-
CARBOXYMETHYL-AMINO}-ACETIC ACID
A1NNF0.72
EDT{[-(BIS-CARBOXYMETHYL-AMINO)-ETHYL]-
CARBOXYMETHYL-AMINO}-ACETIC ACID
A,B1ZLQ0.72
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B2IXX0.8
MHA(CARBAMOYLMETHYL-CARBOXYMETHYL-
AMINO)-ACETIC ACID
A,B1IX10.8
HAD(CARBOXYHYDROXYAMINO)ETHANOIC ACIDA1KKB0.7
HAD(CARBOXYHYDROXYAMINO)ETHANOIC ACIDA1GIM0.7
HAD(CARBOXYHYDROXYAMINO)ETHANOIC ACIDA1GIN0.7
HAD(CARBOXYHYDROXYAMINO)ETHANOIC ACIDA1KSZ0.7
HAD(CARBOXYHYDROXYAMINO)ETHANOIC ACIDA1NHT0.7
HAD(CARBOXYHYDROXYAMINO)ETHANOIC ACIDA1KKF0.7
HAD(CARBOXYHYDROXYAMINO)ETHANOIC ACIDA2GCQ0.7
OGAN-OXALYOLGLYCINEA,B,C,D2OQ60.76
OGAN-OXALYOLGLYCINEA2RDS0.76
OGAN-OXALYOLGLYCINEA1H2M0.76
OGAN-OXALYOLGLYCINEA2QRL0.76
OGAN-OXALYOLGLYCINEA,B,C,D2OX00.76
OGAN-OXALYOLGLYCINEA2RDR0.76
OGAN-OXALYOLGLYCINEA,B,C,D2OS20.76
OGAN-OXALYOLGLYCINEA,B,I,J2PXJ0.76
OGAN-OXALYOLGLYCINEA,B,F,G2Q8E0.76
OGAN-OXALYOLGLYCINEA,B,I,J2P5B0.76
OGAN-OXALYOLGLYCINEA1H2K0.76
OGAN-OXALYOLGLYCINEA,B,C,D2OT70.76
OGAN-OXALYOLGLYCINEA,B2OQ70.76
CMSCARBAMOYL SARCOSINEA,B1CHM0.93
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA,B1U6R0.84
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA1RL90.84
IOM(DIAMINOMETHYL-METHYL-AMINO)-ACETIC ACIDA,B1VRP0.84
BCNBICINEA,B,C,D2V8H0.73
BCNBICINEA1QUS0.73
BCNBICINEA1LTM0.73
BCNBICINEA2JC50.73
BCNBICINEA,B,C,D1V0J0.73
BCNBICINEA1QDR0.73
BCNBICINEA1KI00.73
BCNBICINEY,Z1KMI0.73
BCNBICINEA,B,C2OV50.73
BCNBICINEA2A810.73
BCNBICINEA,B,C,D2V8G0.73
BCNBICINEA,B3HWR0.73
BCNBICINEA2R6S0.73
BCNBICINEA,B2R4J0.73
AACACETYLAMINO-ACETIC ACIDA,B1NG30.74
AACACETYLAMINO-ACETIC ACIDA1QD80.74
BETTRIMETHYL GLYCINEA1RCC0.71
BETTRIMETHYL GLYCINEA,B3DSB0.71
BETTRIMETHYL GLYCINEA1RCI0.71
BETTRIMETHYL GLYCINEA1SW20.71
BETTRIMETHYL GLYCINEA1RCE0.71
BETTRIMETHYL GLYCINEA1R9L0.71
BETTRIMETHYL GLYCINEA1RCD0.71
BETTRIMETHYL GLYCINEA,B,C2WIT0.71
BETTRIMETHYL GLYCINEA2B4L0.71
BETTRIMETHYL GLYCINEA1RCG0.71
BETTRIMETHYL GLYCINEA,B,C,D1WWJ0.71
DMGN,N-DIMETHYLGLYCINEA,B,C,D1VRQ0.71
DMGN,N-DIMETHYLGLYCINEA,B,C,D1X310.71
DMGN,N-DIMETHYLGLYCINEA,B,C1XKP0.71
DMGN,N-DIMETHYLGLYCINEA,B1EL50.71
NTANITRILOTRIACETIC ACIDA1GVC0.78
NTANITRILOTRIACETIC ACIDA1NFT0.78
OXCOXONIC ACIDA,B2E6F0.78
OXCOXONIC ACIDA1R4U0.78
CRNN-[(E)-AMINO(IMINO)METHYL]-N-METHYLGLYCINEA,B3B6R0.77
CRNN-[(E)-AMINO(IMINO)METHYL]-N-METHYLGLYCINEA,B,C,D,E,F1V7Z0.77
NCBN-CARBAMOYL-ALANINEA,B,C,D,E,F,
G,H,I,J
1QMV0.76