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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02864527

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2OUA0.87
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B,C,D2AJC0.87
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B3PRO0.87
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2PFE0.87
M25N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDEA,B2NMX0.76
M25N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDEA2NNS0.76
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.74
BHYN,N'-[biphenyl-4,4'-diyldi(2R)propane-
2,1-diyl]dimethanesulfonamide
A,B3BBR0.79
BZZBENZYLHYDRAZINEA,B2E2V0.7
MAJindane-5-sulfonamideA2QOA0.7
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.7
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.7
EOAN-PHENETHYL-FORMAMIDEH,I1A5G0.75
B2FPHENYLALANINE BORONIC ACIDA,P1GBM0.85
B2FPHENYLALANINE BORONIC ACIDA,P1GBD0.85
B2FPHENYLALANINE BORONIC ACIDA,P1P060.85
B2FPHENYLALANINE BORONIC ACIDA,P1GBI0.85
B2FPHENYLALANINE BORONIC ACIDA,P8LPR0.85
FBA4-FLUOROBENZYLAMINEB,D,E1AFQ0.74
FBA4-FLUOROBENZYLAMINEA1TNH0.74
DMX3-[BENZYL(DIMETHYL)AMMONIO]PROPANE-
1-SULFONATE
A,B,C,D1TP70.81
271N-methyl-1-phenylmethanamineX2RBT0.72
BCSBENZYLCYSTEINEA,B,G,H10GS0.7
BCSBENZYLCYSTEINEA1EH80.7
0071-METHYLAMINE-1-BENZYL-CYCLOPENTANEA,B,C,D2BUA0.75
ABNBENZYLAMINED,H2HXC0.77
ABNBENZYLAMINEA,I1A860.77
ABNBENZYLAMINEA1UTN0.77
ABNBENZYLAMINEA1N6X0.77
ABNBENZYLAMINEA2BZA0.77
ABNBENZYLAMINEA2EUS0.77
ABNBENZYLAMINEA1N6Y0.77
ABNBENZYLAMINEA1UTJ0.77
FRD1-PHENYL-2-AMINOPROPANEA,C2AOI0.8
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOF0.8
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOJ0.8
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOH0.8
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3B2Q0.89
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4T0.89
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4R0.89
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3EIU0.89
BSA2-(BENZOYLAMINO)ETHANESULFONIC ACIDA1YQS0.7
FPA1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDEE,I4EST0.7
AM44-(METHYLSULFONYL)BENZENECARBOXIMIDAMIDEA1TX80.7