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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03081671

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ML32-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}-
N,N,N-trimethylethanaminium
F3C1B0.74
SMEMETHIONINE SULFOXIDEA1GWF0.8
SMEMETHIONINE SULFOXIDEA2JUY0.8
SMEMETHIONINE SULFOXIDEA2O7A0.8
SMEMETHIONINE SULFOXIDEA2ATM0.8
SMEMETHIONINE SULFOXIDEA,B1GM90.8
SMEMETHIONINE SULFOXIDEA1BA60.8
SMEMETHIONINE SULFOXIDEA,B,C,D,E,F2OQE0.8
SMEMETHIONINE SULFOXIDEA,B1GM70.8
SMEMETHIONINE SULFOXIDEA,B,C,D,E,F2OOV0.8
SMEMETHIONINE SULFOXIDEA,B1GKF0.8
SMEMETHIONINE SULFOXIDEA1WMF0.8
BSC(S)-2-AMINO-4-(AMINO-BUTYLHYDROSULFINYL)BUTANOIC ACIDA,B,C,D,E,F,
G,H
2GWC0.86
OMTS-DIOXYMETHIONINEA,B1EA00.77
OMTS-DIOXYMETHIONINEA1E930.77
OMTS-DIOXYMETHIONINEA2CAH0.77
OMTS-DIOXYMETHIONINEA,B,C,D2F1K0.77
OMTS-DIOXYMETHIONINEA,B,C,D,E,F,
G,H
2ISA0.77
OMTS-DIOXYMETHIONINEA1MQF0.77
OMTS-DIOXYMETHIONINEA1M850.77
OMTS-DIOXYMETHIONINEA2CAG0.77
OMTS-DIOXYMETHIONINEA1H7K0.77
OMTS-DIOXYMETHIONINEA1NM00.77
OMTS-DIOXYMETHIONINEA,B,C,D,E,F,
G,H,I,J,K,L
2VDC0.77
OMTS-DIOXYMETHIONINEA1H6N0.77
MSL(2S)-2-AMINO-4-(METHYLSULFONIMIDOYL)BUTANOIC ACIDA,B2J8R0.82
MSL(2S)-2-AMINO-4-(METHYLSULFONIMIDOYL)BUTANOIC ACIDA,B,C,D,E,F,
G,H,I,J
2D3B0.82
SCYS-ACETYL-CYSTEINEA,B,C,D1XPK0.73
SCYS-ACETYL-CYSTEINEA,B,C,D1XPL0.73
SCYS-ACETYL-CYSTEINEA,B2P8U0.73
SCYS-ACETYL-CYSTEINEA2FA30.73
SCYS-ACETYL-CYSTEINEA,B,C,D2F2S0.73
SCYS-ACETYL-CYSTEINEA1MJA0.73
SCYS-ACETYL-CYSTEINEA1HNH0.73
SCYS-ACETYL-CYSTEINEA,B,C,D1XPM0.73
SCYS-ACETYL-CYSTEINEA,B,C,D1DM30.73
SCYS-ACETYL-CYSTEINEA,B,C,D1QFL0.73
SCYS-ACETYL-CYSTEINEA,B,C,D1NL70.73
SCYS-ACETYL-CYSTEINEA2BV50.73
SCYS-ACETYL-CYSTEINEA,B,C,D1M4S0.73
P3SL-METHIONINE-S-SULFOXIMINE PHOSPHATEA,B,C,D,E,F,
G,H,I,J
2D3A0.73
P3SL-METHIONINE-S-SULFOXIMINE PHOSPHATEA,B,C,D,E,F,
G,H,I,J
2QC80.73
P3SL-METHIONINE-S-SULFOXIMINE PHOSPHATEA,B,C,D,E,F2BVC0.73
P2S(2S)-2-AMINO-4-[[(2R)-2-CARBOXYBUTYL](PHOSPHONO)SULFONIMIDOYL]BUTANOIC ACIDA,B1VA60.78
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B,C,D1L0Q0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B,I3DCR0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B2A8Q0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B3FL10.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,I2O400.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEL2R0Z0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B1TQ90.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEL2R0W0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B1PX50.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEH,L1TJG0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEH,L3EYU0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA1N3Z0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B2A8S0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEH,L,Q3EYS0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA3ESW0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B,C,D3BCP0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B3FKZ0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B3FL30.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEH,L,P1TJI0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B2A8P0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B2A8R0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B3FL00.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA1N1X0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEH,L,P1TJH0.7
YCMS-(2-AMINO-2-OXOETHYL)-L-CYSTEINEA,B,I3DCK0.7
GT9S-NONYL-CYSTEINEA,B,C,D12GS0.71
DIVD-ISOVALINEA1IH90.71
DIVD-ISOVALINEA1DLZ0.71
DIVD-ISOVALINEA1OB40.71
DIVD-ISOVALINEA,B1JOH0.71
DIVD-ISOVALINEA1EE70.71
DIVD-ISOVALINEA,B1OB60.71
DIVD-ISOVALINEA1GQ00.71
DIVD-ISOVALINEA1OB70.71
DIVD-ISOVALINEA1R9U0.71
SHCS-HEXYLCYSTEINEI,J1GSS0.74
SMCS-METHYLCYSTEINEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W
1UZD0.71
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDI0.71
SMCS-METHYLCYSTEINEA1U8B0.71
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDH0.71
SMCS-METHYLCYSTEINEA1FQ40.71
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBO0.71
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V630.71
SMCS-METHYLCYSTEINEI1E820.71
SMCS-METHYLCYSTEINEI1E810.71
SMCS-METHYLCYSTEINEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W
1UW90.71
SMCS-METHYLCYSTEINEA1LFO0.71
SMCS-METHYLCYSTEINEA,B,D,E,H,K,
O,R,V
1UWA0.71
SMCS-METHYLCYSTEINEA,C,D,F1MRO0.71
SMCS-METHYLCYSTEINE1,2,3,4,5,6,
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
1IR20.71
SMCS-METHYLCYSTEINEA1ZGW0.71
SMCS-METHYLCYSTEINEE,I1EPN0.71
SMCS-METHYLCYSTEINEA,B,C2OB20.71
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V670.71
SMCS-METHYLCYSTEINEP1CZI0.71
SMCS-METHYLCYSTEINEA,C,D,F1E6Y0.71
SMCS-METHYLCYSTEINEA,I1GVT0.71
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBM0.71
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V680.71
SMCS-METHYLCYSTEINEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W
1UZH0.71
SMCS-METHYLCYSTEINEA1EH70.71
SMCS-METHYLCYSTEINEA,C,E,G,I,K,
M,O
1GK80.71
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V6A0.71
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V690.71
SMCS-METHYLCYSTEINEA1WPK0.71
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBN0.71
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBU0.71
KORL-HOMOCYSTEINE-S-N-S-L-CYSTEINEA2CI10.71
CSAS-ACETONYLCYSTEINEA,B1DWQ0.7
M2L(2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acidA2K3Y0.72
M2L(2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acidA,E3C1C0.72
CBHS-(D-CARBOXYBUTYL)-L-HOMOCYSTEINEA,B1LT80.73
MEDD-METHIONINEA1Y9Q0.75
MEDD-METHIONINEA,B2Q330.75
MEDD-METHIONINEA1ZUE0.75
MEDD-METHIONINEA1KQ00.75
MEDD-METHIONINEA,B3GP40.75
MEDD-METHIONINEA1TKJ0.75
SLZL-THIALYSINEA,B,D,E,F2O6V0.73
SLZL-THIALYSINEA,B,D2J9K0.73
SLZL-THIALYSINEL1BM20.73
SLZL-THIALYSINEX3DIG0.73
SLZL-THIALYSINEA,B,C2J9J0.73
SDCS-[2-(AMINOSULFONYL)ETHYL]-D-CYSTEINEA,B,C1R1O0.73
MHOS-OXYMETHIONINEA,B2A9E0.8
MHOS-OXYMETHIONINEA1ST20.8
MHOS-OXYMETHIONINEA1NLR0.8
MHOS-OXYMETHIONINEA2IDU0.8
MHOS-OXYMETHIONINEA3D940.8
MHOS-OXYMETHIONINEA1EK00.8
MHOS-OXYMETHIONINEA1UP20.8
MHOS-OXYMETHIONINEA1XJO0.8
MHOS-OXYMETHIONINEA,E2IUF0.8
MHOS-OXYMETHIONINEA1SF50.8
MHOS-OXYMETHIONINEA1UP00.8
MHOS-OXYMETHIONINEA9PTI0.8
MHOS-OXYMETHIONINEA2IDT0.8
MHOS-OXYMETHIONINEA2QDV0.8
MHOS-OXYMETHIONINEA2QDW0.8
MHOS-OXYMETHIONINEA,B1F4G0.8
MHOS-OXYMETHIONINEA,B2IQF0.8
CY4S-BUTYRYL-CYSTEINA,B,C,D1M4T0.75
MT2[(3S)-3-amino-3-carboxypropyl](ethyl)methylsulfoniumA3C8F0.78
ESC2-AMINO-4-ETHYL SULFANYL BUTYRIC ACIDH,P1KBG0.76