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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03206877

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CS0S-(2-HYDROXYETHYL)-L-CYSTEINEA1ASV0.7
N2CN,S-DIMETHYLCYSTEINEA1XVK0.73
N2CN,S-DIMETHYLCYSTEINEA,C1XVR0.73
N2CN,S-DIMETHYLCYSTEINEA,B3GO30.73
I38N-(3-MERCAPTOPROPANOYL)-D-ALANINEA2QDT0.77
DSEN-METHYL-D-SERINEC1CWH0.7
NCYN-METHYLCYSTEINEA,C,E,G2ADW0.79
NCYN-METHYLCYSTEINEA1VS20.79
NCYN-METHYLCYSTEINEA1PFE0.79
NCYN-METHYLCYSTEINEA,B2DA80.79
NCYN-METHYLCYSTEINEC,D193D0.79
NCYN-METHYLCYSTEINEA1XVN0.79
NCYN-METHYLCYSTEINEA,B185D0.79
NCYN-METHYLCYSTEINEA1XVK0.79
NCYN-METHYLCYSTEINEA,C1XVR0.79
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F,
G,H
2J580.75
SC2N-ACETYL-L-CYSTEINEA,B,C,D,E,F2J2P0.75
SC2N-ACETYL-L-CYSTEINEB,C,D,E,F2J1G0.75
MMEN-METHYL METHIONINEA,C,E,G,I,K,
M,O
1GK80.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V6A0.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V690.73
MMEN-METHYL METHIONINEA,E,S,W1WDD0.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V680.73
MMEN-METHYL METHIONINEA,B,C,D,S,T,
U,V
1IR10.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V670.73
MMEN-METHYL METHIONINE1,2,3,4,5,6,
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
1IR20.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V630.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDH0.73
MMEN-METHYL METHIONINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDI0.73
OCYHYDROXYETHYLCYSTEINEA1VSH0.7
OCYHYDROXYETHYLCYSTEINEA3FV80.7
OCYHYDROXYETHYLCYSTEINEA3FI30.7
OCYHYDROXYETHYLCYSTEINEA,B2R9S0.7
OCYHYDROXYETHYLCYSTEINEA1VSI0.7
OCYHYDROXYETHYLCYSTEINEA1VSJ0.7
OCYHYDROXYETHYLCYSTEINEA1VSD0.7
OCYHYDROXYETHYLCYSTEINEA3FI20.7
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1HW40.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F2C5Q0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEI,J,K,L,M,N,
O,P
1JZ10.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,D2C4O0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GEV0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1HQS0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2G5O0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2G4L0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,G,H3CFA0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1PZG0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2B1V0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1Q9U0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1QQQ0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XM40.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1WDR0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2EF80.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XMY0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEI,J,K,L,M,N,
O,P
1JYZ0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA3EWY0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1PME0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1Y8Z0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1YI40.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA3EWX0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2VB00.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2FAI0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1QVV0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA3FS50.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1XOS0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GES0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XMU0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1J3H0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,D2CLW0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEB,D,F,H,J,L1YKO0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1ELJ0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEE1R8M0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,G,H3CFF0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XOT0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1EUD0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1EVF0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2OQX0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1Y2J0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA3C7Q0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1QVW0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,C,D1K2X0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1ZKY0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2A2J0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1EV80.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1WZ90.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1YHS0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GA80.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GAA0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2P3B0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,I1ZPK0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2B1Z0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1A1V0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1A2T0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1Y2H0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1YPV0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F,
G,H
1JYY0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,I1Z8C0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2QXS0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B3ET00.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2P3A0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1KSH0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,G,H3CFH0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2V1P0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1OCS0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2G440.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2J830.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1EV50.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1L6Y0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2V0Y0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2Q590.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1JVY0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2P3C0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2AQ50.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,E1S9D0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1JEO0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2CZL0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2OCF0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1YI30.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F,
Y,Z
2OX50.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1EVG0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2RD80.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2B230.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C1HQG0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2CFA0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEI,J,K,L,M,N,
O,P
1GHO0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XLX0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEB,D,F,H,J,L1YKK0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1HW30.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1JN90.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,D,F,H,J,L1YKP0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XLZ0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1TAZ0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GET0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2QA80.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B2QZO0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1XV50.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F,
G,H
1JZ00.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XN00.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1UPI0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEB,D,F,H,J,L1YKM0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1XM60.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEB,D,F,H,J,L1YKN0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2ONB0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA1TLV0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D1HVY0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B3D6I0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1OCU0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,I1ZBG0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2GEU0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA2HAI0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1EUC0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B,C,D,E,F,
G,H
1F490.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1L6S0.74
CMES,S-(2-HYDROXYETHYL)THIOCYSTEINEA,B1KSJ0.74
THCN-METHYLCARBONYLTHREONINEA,B,C1A7C0.71
THCN-METHYLCARBONYLTHREONINEB2HR00.71
THCN-METHYLCARBONYLTHREONINEL,P2MPA0.71
THCN-METHYLCARBONYLTHREONINEL,P1MPA0.71