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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03446185

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
F3C1B0.73
ESC2-AMINO-4-ETHYL SULFANYL BUTYRIC ACIDH,P1KBG0.75
CS0S-(2-HYDROXYETHYL)-L-CYSTEINEA1ASV0.72
P3SL-METHIONINE-S-SULFOXIMINE PHOSPHATEA,B,C,D,E,F,
G,H,I,J
2D3A0.72
P3SL-METHIONINE-S-SULFOXIMINE PHOSPHATEA,B,C,D,E,F,
G,H,I,J
2QC80.72
P3SL-METHIONINE-S-SULFOXIMINE PHOSPHATEA,B,C,D,E,F2BVC0.72
OCYHYDROXYETHYLCYSTEINEA1VSH0.72
OCYHYDROXYETHYLCYSTEINEA3FV80.72
OCYHYDROXYETHYLCYSTEINEA3FI30.72
OCYHYDROXYETHYLCYSTEINEA,B2R9S0.72
OCYHYDROXYETHYLCYSTEINEA1VSI0.72
OCYHYDROXYETHYLCYSTEINEA1VSJ0.72
OCYHYDROXYETHYLCYSTEINEA1VSD0.72
OCYHYDROXYETHYLCYSTEINEA3FI20.72
SCYS-ACETYL-CYSTEINEA,B,C,D1XPK0.72
SCYS-ACETYL-CYSTEINEA,B,C,D1XPL0.72
SCYS-ACETYL-CYSTEINEA,B2P8U0.72
SCYS-ACETYL-CYSTEINEA2FA30.72
SCYS-ACETYL-CYSTEINEA,B,C,D2F2S0.72
SCYS-ACETYL-CYSTEINEA1MJA0.72
SCYS-ACETYL-CYSTEINEA1HNH0.72
SCYS-ACETYL-CYSTEINEA,B,C,D1XPM0.72
SCYS-ACETYL-CYSTEINEA,B,C,D1DM30.72
SCYS-ACETYL-CYSTEINEA,B,C,D1QFL0.72
SCYS-ACETYL-CYSTEINEA,B,C,D1NL70.72
SCYS-ACETYL-CYSTEINEA2BV50.72
SCYS-ACETYL-CYSTEINEA,B,C,D1M4S0.72
BSC(S)-2-AMINO-4-(AMINO-BUTYLHYDROSULFINYL)BUTANOIC ACIDA,B,C,D,E,F,
G,H
2GWC0.84
P2S(2S)-2-AMINO-4-[[(2R)-2-CARBOXYBUTYL](PHOSPHONO)SULFONIMIDOYL]BUTANOIC ACIDA,B1VA60.72
MSL(2S)-2-AMINO-4-(METHYLSULFONIMIDOYL)BUTANOIC ACIDA,B2J8R0.81
MSL(2S)-2-AMINO-4-(METHYLSULFONIMIDOYL)BUTANOIC ACIDA,B,C,D,E,F,
G,H,I,J
2D3B0.81
SHCS-HEXYLCYSTEINEI,J1GSS0.73
SMEMETHIONINE SULFOXIDEA1GWF0.79
SMEMETHIONINE SULFOXIDEA2JUY0.79
SMEMETHIONINE SULFOXIDEA2O7A0.79
SMEMETHIONINE SULFOXIDEA2ATM0.79
SMEMETHIONINE SULFOXIDEA,B1GM90.79
SMEMETHIONINE SULFOXIDEA1BA60.79
SMEMETHIONINE SULFOXIDEA,B,C,D,E,F2OQE0.79
SMEMETHIONINE SULFOXIDEA,B1GM70.79
SMEMETHIONINE SULFOXIDEA,B,C,D,E,F2OOV0.79
SMEMETHIONINE SULFOXIDEA,B1GKF0.79
SMEMETHIONINE SULFOXIDEA1WMF0.79
OMTS-DIOXYMETHIONINEA,B1EA00.76
OMTS-DIOXYMETHIONINEA1E930.76
OMTS-DIOXYMETHIONINEA2CAH0.76
OMTS-DIOXYMETHIONINEA,B,C,D2F1K0.76
OMTS-DIOXYMETHIONINEA,B,C,D,E,F,
G,H
2ISA0.76
OMTS-DIOXYMETHIONINEA1MQF0.76
OMTS-DIOXYMETHIONINEA1M850.76
OMTS-DIOXYMETHIONINEA2CAG0.76
OMTS-DIOXYMETHIONINEA1H7K0.76
OMTS-DIOXYMETHIONINEA1NM00.76
OMTS-DIOXYMETHIONINEA,B,C,D,E,F,
G,H,I,J,K,L
2VDC0.76
OMTS-DIOXYMETHIONINEA1H6N0.76
M2L(2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acidA2K3Y0.72
M2L(2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acidA,E3C1C0.72
MHOS-OXYMETHIONINEA,B2A9E0.79
MHOS-OXYMETHIONINEA1ST20.79
MHOS-OXYMETHIONINEA1NLR0.79
MHOS-OXYMETHIONINEA2IDU0.79
MHOS-OXYMETHIONINEA3D940.79
MHOS-OXYMETHIONINEA1EK00.79
MHOS-OXYMETHIONINEA1UP20.79
MHOS-OXYMETHIONINEA1XJO0.79
MHOS-OXYMETHIONINEA,E2IUF0.79
MHOS-OXYMETHIONINEA1SF50.79
MHOS-OXYMETHIONINEA1UP00.79
MHOS-OXYMETHIONINEA9PTI0.79
MHOS-OXYMETHIONINEA2IDT0.79
MHOS-OXYMETHIONINEA2QDV0.79
MHOS-OXYMETHIONINEA2QDW0.79
MHOS-OXYMETHIONINEA,B1F4G0.79
MHOS-OXYMETHIONINEA,B2IQF0.79
MEDD-METHIONINEA1Y9Q0.74
MEDD-METHIONINEA,B2Q330.74
MEDD-METHIONINEA1ZUE0.74
MEDD-METHIONINEA1KQ00.74
MEDD-METHIONINEA,B3GP40.74
MEDD-METHIONINEA1TKJ0.74
HTI(4S)-4-{[(2S)-2-AMINO-3-OXOPROPYL]SULFANYL}-
L-HOMOSERINE
C2R000.73
HTI(4S)-4-{[(2S)-2-AMINO-3-OXOPROPYL]SULFANYL}-
L-HOMOSERINE
A,B1NWH0.73
HTI(4S)-4-{[(2S)-2-AMINO-3-OXOPROPYL]SULFANYL}-
L-HOMOSERINE
A1NX60.73
HTI(4S)-4-{[(2S)-2-AMINO-3-OXOPROPYL]SULFANYL}-
L-HOMOSERINE
A1PU20.73
HTI(4S)-4-{[(2S)-2-AMINO-3-OXOPROPYL]SULFANYL}-
L-HOMOSERINE
A,B1Q2X0.73
CMTO-METHYLCYSTEINEG1OMW0.73
CMTO-METHYLCYSTEINEA,G3CIK0.73
CMTO-METHYLCYSTEINEA1DOA0.73
SDCS-[2-(AMINOSULFONYL)ETHYL]-D-CYSTEINEA,B,C1R1O0.72
MT2[(3S)-3-amino-3-carboxypropyl](ethyl)methylsulfoniumA3C8F0.77
CY4S-BUTYRYL-CYSTEINA,B,C,D1M4T0.74
GT9S-NONYL-CYSTEINEA,B,C,D12GS0.7
SLZL-THIALYSINEA,B,D,E,F2O6V0.72
SLZL-THIALYSINEA,B,D2J9K0.72
SLZL-THIALYSINEL1BM20.72
SLZL-THIALYSINEX3DIG0.72
SLZL-THIALYSINEA,B,C2J9J0.72
SMCS-METHYLCYSTEINEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W
1UZD0.7
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDI0.7
SMCS-METHYLCYSTEINEA1U8B0.7
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDH0.7
SMCS-METHYLCYSTEINEA1FQ40.7
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBO0.7
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V630.7
SMCS-METHYLCYSTEINEI1E820.7
SMCS-METHYLCYSTEINEI1E810.7
SMCS-METHYLCYSTEINEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W
1UW90.7
SMCS-METHYLCYSTEINEA1LFO0.7
SMCS-METHYLCYSTEINEA,B,D,E,H,K,
O,R,V
1UWA0.7
SMCS-METHYLCYSTEINEA,C,D,F1MRO0.7
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
1IR20.7
SMCS-METHYLCYSTEINEA1ZGW0.7
SMCS-METHYLCYSTEINEE,I1EPN0.7
SMCS-METHYLCYSTEINEA,B,C2OB20.7
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V670.7
SMCS-METHYLCYSTEINEP1CZI0.7
SMCS-METHYLCYSTEINEA,C,D,F1E6Y0.7
SMCS-METHYLCYSTEINEA,I1GVT0.7
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBM0.7
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V680.7
SMCS-METHYLCYSTEINEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W
1UZH0.7
SMCS-METHYLCYSTEINEA1EH70.7
SMCS-METHYLCYSTEINEA,C,E,G,I,K,
M,O
1GK80.7
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V6A0.7
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V690.7
SMCS-METHYLCYSTEINEA1WPK0.7
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBN0.7
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBU0.7
KORL-HOMOCYSTEINE-S-N-S-L-CYSTEINEA2CI10.7
CBHS-(D-CARBOXYBUTYL)-L-HOMOCYSTEINEA,B1LT80.72