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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02546451

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LBYN~6~-(TERT-BUTOXYCARBONYL)-L-LYSINEA2ZIN0.85
MNL4,N-DIMETHYLNORLEUCINEC1CWC0.74
BRR(2R)-2-{[FORMYL(HYDROXY)AMINO]METHYL}HEXANOIC ACIDA,B1RL40.71
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2QF70.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D2RJG0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D3B8T0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2SFP0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1PU60.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,C,E,G1BWV0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2VTD0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2Z2A0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V690.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W
1UZD0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1XGE0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1XQK0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D2FTY0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2Z2B0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1K4E0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1K6S0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,C1S3T0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1W7K0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D2RJH0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA3GU90.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1L6G0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2Z240.74
KCXLYSINE NZ-CARBOXYLIC ACIDB,E,H,K,L,O,
R,V
1UPM0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA3FDK0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1RCQ0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2EG60.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D3E740.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1EJV0.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1FWD0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA3GU10.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D3B8W0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1PU70.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1POK0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2Z290.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1S3H0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,K,P2O4Q0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D1E4D0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1K380.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2FTW0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D1GKQ0.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1EJX0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2R1K0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D3HBR0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2JFG0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2VTE0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1H010.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1VFH0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2QPX0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA3C0Q0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B3DC80.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D2VC70.74
KCXLYSINE NZ-CARBOXYLIC ACIDA3GTF0.74
KCXLYSINE NZ-CARBOXYLIC ACIDC2KAU0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1HL80.74
KCXLYSINE NZ-CARBOXYLIC ACIDB1E9Y0.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1FWB0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D,E,F,
G,H
1K1D0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1U5J0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D1GKR0.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1FWE0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1UAG0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1PO90.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1EJR0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1RQB0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V670.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1EJS0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D1K570.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D3B8U0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W
1UZH0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D2FVK0.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1EJU0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1EYW0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2R1N0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2Z270.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,P2O4M0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D1K540.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1L6F0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2AQV0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1JGM0.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1KRB0.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1EJT0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA3GNH0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D3BG30.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D,E,F,
G,H
3DUG0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDI0.74
KCXLYSINE NZ-CARBOXYLIC ACIDB1E9Z0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1POJ0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2EG70.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1FWF0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1E8C0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V630.74
KCXLYSINE NZ-CARBOXYLIC ACIDA3GTH0.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1FWC0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D3B8V0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2UAG0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W
1UW90.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,C3UBP0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1JBV0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D1NFG0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1ONX0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1YBQ0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA3HTW0.74
KCXLYSINE NZ-CARBOXYLIC ACID1,2,3,4,5,6,
7,8,A,B,C,D,
E,F,G,H,I,J,
K,L,M,N,O,P,
S,T,U,V,W,X,
Y,Z
1IR20.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1EZ20.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1FWJ0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2Z250.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1XQL0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2UUP0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1VFT0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA4UAG0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2AQO0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,C1UBP0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D,S,T,
U,V
1IR10.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2R1P0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,C2UBP0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V680.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,C1IE70.74
KCXLYSINE NZ-CARBOXYLIC ACIDB,E,H,L1RXO0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,E,S,W1WDD0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1EF20.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2Z280.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,C,E,G,I,K,
M,O
1GK80.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2JFH0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V6A0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1OIR0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2P9V0.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1FWI0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1JBW0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D1K550.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2E250.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1EPV0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1J790.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,C4UBP0.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1FWA0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA3C0S0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2RL30.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1FWH0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2JFF0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA3GTX0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1W780.74
KCXLYSINE NZ-CARBOXYLIC ACIDA3GTI0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1VFS0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2OEL0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1M6K0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1P6B0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2Z260.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,C,E,G8RUC0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2R1L0.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1FWG0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D1K560.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2OEK0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2UUO0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1RQH0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2EG80.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D2FVM0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1PU80.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2R1M0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1ONW0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA1RR20.74
KCXLYSINE NZ-CARBOXYLIC ACIDA3GU20.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D2ODO0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1K4F0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1HL90.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDH0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C2UYN0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2OEM0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2GC50.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1FTX0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,D,E,H,K,
O,R,V
1UWA0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2GWN0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D,E,F1GKP0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA3UAG0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA2ZC10.74
KCXLYSINE NZ-CARBOXYLIC ACIDC1EJW0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B2J6V0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1P6C0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1QW70.74
KCXLYSINE NZ-CARBOXYLIC ACIDB,E,H,L1AA10.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,C,E,G1UPP0.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B,C,D2VC50.74
KCXLYSINE NZ-CARBOXYLIC ACIDA,B1NIU0.74
MHLN-METHYL-4-HYDROXY-LEUCINEC1CWL0.7
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C3HEZ0.74
BIL(3R,4S)-3-amino-4-methylhexanoic acidA,B,C,D3C3F0.74
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3HF00.74
BIL(3R,4S)-3-amino-4-methylhexanoic acidA3C3G0.74
0AGN-(ethoxycarbonyl)-L-leucineI,J1PSA0.8
DZEmethyl (3S)-3-[(tert-butoxycarbonyl)amino]-
4-oxopentanoate
A,B,C,D3GJR0.76
B3L(3S)-3-amino-5-methylhexanoic acidA3C3H0.77
B3L(3S)-3-amino-5-methylhexanoic acidA3C3G0.77
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C,D3C3F0.77
B3L(3S)-3-amino-5-methylhexanoic acidA,B,C3HEZ0.77
B3L(3S)-3-amino-5-methylhexanoic acidA,B,D,E,F3FDM0.77
ALYN(6)-ACETYLLYSINEA,B2B4D0.73
ALYN(6)-ACETYLLYSINEA,B2OD90.73
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.73
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.73
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.73
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.73
ALYN(6)-ACETYLLYSINEA,B2B5G0.73
ALYN(6)-ACETYLLYSINEA2GIV0.73
ALYN(6)-ACETYLLYSINEB2RNY0.73
ALYN(6)-ACETYLLYSINEA1JSP0.73
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.73
ALYN(6)-ACETYLLYSINEA,D3D4B0.73
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.73
ALYN(6)-ACETYLLYSINEA,B2R0Y0.73
ALYN(6)-ACETYLLYSINEA3CZ70.73
ALYN(6)-ACETYLLYSINEA1JM40.73
ALYN(6)-ACETYLLYSINEA,B2H4H0.73
ALYN(6)-ACETYLLYSINEA,B2J6V0.73
ALYN(6)-ACETYLLYSINEA,B2R100.73
ALYN(6)-ACETYLLYSINEA,B1YC50.73
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.73
ALYN(6)-ACETYLLYSINEA,B2H2G0.73
ALYN(6)-ACETYLLYSINEA,D2H4F0.73
ALYN(6)-ACETYLLYSINEA2OU20.73
ALYN(6)-ACETYLLYSINEA,B1S5P0.73
ALYN(6)-ACETYLLYSINEB2RNW0.73
ALYN(6)-ACETYLLYSINEA3D350.73
ALYN(6)-ACETYLLYSINEA,B2OD20.73
ALYN(6)-ACETYLLYSINEA2ZFN0.73
ALYN(6)-ACETYLLYSINEC,D2C1J0.73
ALYN(6)-ACETYLLYSINEA,B2QQG0.73
ALYN(6)-ACETYLLYSINEB2RNX0.73
ALYN(6)-ACETYLLYSINEA,B1MA30.73
ALYN(6)-ACETYLLYSINEA,B2H2H0.73
ALYN(6)-ACETYLLYSINEA2I2Z0.73
ALYN(6)-ACETYLLYSINEA,B2OD70.73
ALYN(6)-ACETYLLYSINEP1E6I0.73
ALYN(6)-ACETYLLYSINEA,B1SZC0.73
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.73
ALYN(6)-ACETYLLYSINEA,B2H2D0.73
ALYN(6)-ACETYLLYSINEA,B1Q1A0.73
ALYN(6)-ACETYLLYSINEA,B1SZD0.73
ALYN(6)-ACETYLLYSINEQ,R2E3K0.73
ALYN(6)-ACETYLLYSINEA2OZU0.73
ALYN(6)-ACETYLLYSINEA,B2QQF0.73
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.73
CCLN~6~-[(CYCLOPENTYLOXY)CARBONYL]-
D-LYSINE
A2Q7G0.75
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.72
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA1DAG0.74
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA1DAF0.74
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA,B,C,D3FMF0.74
DSD7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACIDA1DAI0.74
DAA8-AMINO-7-CARBOXYAMINO-NONANOIC ACID WITH ALUMINUM FLUORIDEA1BS10.72