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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03692772

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SCYS-ACETYL-CYSTEINEA,B,C,D1XPK0.75
SCYS-ACETYL-CYSTEINEA,B,C,D1XPL0.75
SCYS-ACETYL-CYSTEINEA,B2P8U0.75
SCYS-ACETYL-CYSTEINEA2FA30.75
SCYS-ACETYL-CYSTEINEA,B,C,D2F2S0.75
SCYS-ACETYL-CYSTEINEA1MJA0.75
SCYS-ACETYL-CYSTEINEA1HNH0.75
SCYS-ACETYL-CYSTEINEA,B,C,D1XPM0.75
SCYS-ACETYL-CYSTEINEA,B,C,D1DM30.75
SCYS-ACETYL-CYSTEINEA,B,C,D1QFL0.75
SCYS-ACETYL-CYSTEINEA,B,C,D1NL70.75
SCYS-ACETYL-CYSTEINEA2BV50.75
SCYS-ACETYL-CYSTEINEA,B,C,D1M4S0.75
CCSCARBOXYMETHYLATED CYSTEINEE1STF0.71
CCSCARBOXYMETHYLATED CYSTEINEA,B,C,D,E,F1GTI0.71
CCSCARBOXYMETHYLATED CYSTEINEA,B2BJ40.71
CCSCARBOXYMETHYLATED CYSTEINEA,B2JFA0.71
CCSCARBOXYMETHYLATED CYSTEINEG,R1DSS0.71
CCSCARBOXYMETHYLATED CYSTEINEA,B1L2I0.71
CCSCARBOXYMETHYLATED CYSTEINEA,B,C,D3DMT0.71
CCSCARBOXYMETHYLATED CYSTEINEA,B1ERR0.71
CCSCARBOXYMETHYLATED CYSTEINEA2JX40.71
M2L(2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acidA2K3Y0.71
M2L(2R)-2-amino-3-(2-dimethylaminoethylsulfanyl)propanoic acidA,E3C1C0.71
CSAS-ACETONYLCYSTEINEA,B1DWQ0.72
SLZL-THIALYSINEA,B,D,E,F2O6V0.71
SLZL-THIALYSINEA,B,D2J9K0.71
SLZL-THIALYSINEL1BM20.71
SLZL-THIALYSINEX3DIG0.71
SLZL-THIALYSINEA,B,C2J9J0.71
S2CS-2-(BORONOETHYL)-L-CYSTEINEA,B1HQ50.71
S2CS-2-(BORONOETHYL)-L-CYSTEINEA,B,C3E9B0.71
S2CS-2-(BORONOETHYL)-L-CYSTEINEA,B1P8R0.71
S2CS-2-(BORONOETHYL)-L-CYSTEINEA,B1WVA0.71
S2CS-2-(BORONOETHYL)-L-CYSTEINEA,B,C,D,E,F1PQ30.71
S2CS-2-(BORONOETHYL)-L-CYSTEINEA,B1WVB0.71
ESC2-AMINO-4-ETHYL SULFANYL BUTYRIC ACIDH,P1KBG0.72
SHCS-HEXYLCYSTEINEI,J1GSS0.73
BPE(2S)-2-AMINO-3-[(3-AMINOPROPYL)SULFANYL]PROPAN-
1-OL
A,B,C1ZPG0.95
MT2[(3S)-3-amino-3-carboxypropyl](ethyl)methylsulfoniumA3C8F0.74
SMCS-METHYLCYSTEINEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W
1UZD0.73
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDI0.73
SMCS-METHYLCYSTEINEA1U8B0.73
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2VDH0.73
SMCS-METHYLCYSTEINEA1FQ40.73
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBO0.73
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V630.73
SMCS-METHYLCYSTEINEI1E820.73
SMCS-METHYLCYSTEINEI1E810.73
SMCS-METHYLCYSTEINEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W
1UW90.73
SMCS-METHYLCYSTEINEA1LFO0.73
SMCS-METHYLCYSTEINEA,B,D,E,H,K,
O,R,V
1UWA0.73
SMCS-METHYLCYSTEINEA,C,D,F1MRO0.73
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
1IR20.73
SMCS-METHYLCYSTEINEA1ZGW0.73
SMCS-METHYLCYSTEINEE,I1EPN0.73
SMCS-METHYLCYSTEINEA,B,C2OB20.73
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V670.73
SMCS-METHYLCYSTEINEP1CZI0.73
SMCS-METHYLCYSTEINEA,C,D,F1E6Y0.73
SMCS-METHYLCYSTEINEA,I1GVT0.73
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBM0.73
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V680.73
SMCS-METHYLCYSTEINEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W
1UZH0.73
SMCS-METHYLCYSTEINEA1EH70.73
SMCS-METHYLCYSTEINEA,C,E,G,I,K,
M,O
1GK80.73
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V6A0.73
SMCS-METHYLCYSTEINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2V690.73
SMCS-METHYLCYSTEINEA1WPK0.73
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBN0.73
SMCS-METHYLCYSTEINEA,B,C,D,E,F1HBU0.73
BBC3-[(4-AMINOBUTYL)SULFINYL]-2-IMINOPROPAN-
1-OL
A,B,C1ZPE0.73
CS0S-(2-HYDROXYETHYL)-L-CYSTEINEA1ASV0.79
CY4S-BUTYRYL-CYSTEINA,B,C,D1M4T0.73
OCYHYDROXYETHYLCYSTEINEA1VSH0.79
OCYHYDROXYETHYLCYSTEINEA3FV80.79
OCYHYDROXYETHYLCYSTEINEA3FI30.79
OCYHYDROXYETHYLCYSTEINEA,B2R9S0.79
OCYHYDROXYETHYLCYSTEINEA1VSI0.79
OCYHYDROXYETHYLCYSTEINEA1VSJ0.79
OCYHYDROXYETHYLCYSTEINEA1VSD0.79
OCYHYDROXYETHYLCYSTEINEA3FI20.79
MEDD-METHIONINEA1Y9Q0.7
MEDD-METHIONINEA,B2Q330.7
MEDD-METHIONINEA1ZUE0.7
MEDD-METHIONINEA1KQ00.7
MEDD-METHIONINEA,B3GP40.7
MEDD-METHIONINEA1TKJ0.7
M0HS-(HYDROXYMETHYL)-L-CYSTEINEA2PFG0.75