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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03462657

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AEA(2-AMINO-2-CARBAMOYL-ETHYLSULFANYL)-
ACETIC ACID
I1BZH0.77
AEA(2-AMINO-2-CARBAMOYL-ETHYLSULFANYL)-
ACETIC ACID
A,B,C,D1MHH0.77
BUCS,S-BUTYLTHIOCYSTEINEA1A2U0.73
0AAmethyl L-valinateI1HEF0.71
C3YS-[(1S)-1-HYDROXY-1-(HYDROXYAMINO)ETHYL]-
L-CYSTEINE
A2UXY0.75
CS0S-(2-HYDROXYETHYL)-L-CYSTEINEA1ASV0.75
CMHS-(METHYLMERCURY)-L-CYSTEINEA,B,C,D1WB20.74
CMHS-(METHYLMERCURY)-L-CYSTEINEA2FOU0.74
CMHS-(METHYLMERCURY)-L-CYSTEINEA2FOS0.74
CMHS-(METHYLMERCURY)-L-CYSTEINEA2NNS0.74
CMHS-(METHYLMERCURY)-L-CYSTEINEA2FOV0.74
CMHS-(METHYLMERCURY)-L-CYSTEINEA,B,C,D1WB30.74
CMHS-(METHYLMERCURY)-L-CYSTEINEA,B,C,D1WB10.74
CMHS-(METHYLMERCURY)-L-CYSTEINEA2NNG0.74
CMHS-(METHYLMERCURY)-L-CYSTEINEA2NNO0.74
CMHS-(METHYLMERCURY)-L-CYSTEINEA2NNV0.74
CMHS-(METHYLMERCURY)-L-CYSTEINEA2FOQ0.74
CML(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acidA2RHY0.78
CML(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acidA2RHU0.78
CML(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acidA2RI20.78
CML(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acidA2RI30.78
CML(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acidA2RI50.78
CML(2S)-2-{[(2R)-2-amino-2-carboxyethyl]sulfanyl}butanedioic acidA2RHZ0.78
ESC2-AMINO-4-ETHYL SULFANYL BUTYRIC ACIDH,P1KBG0.86
CY1ACETAMIDOMETHYLCYSTEINEA,D1D5M0.72
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A1T3T0.73
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A,B,C,D,E,F,
G,H
1A9X0.73
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A,D,E,H,I,L3D540.73
CYG2-AMINO-4-(AMINO-3-OXO-PROPYLSULFANYLCARBONYL)-
BUTYRIC ACID
A,B,C,D,E,F,
G,H
1CS00.73
CCSCARBOXYMETHYLATED CYSTEINEE1STF0.78
CCSCARBOXYMETHYLATED CYSTEINEA,B,C,D,E,F1GTI0.78
CCSCARBOXYMETHYLATED CYSTEINEA,B2BJ40.78
CCSCARBOXYMETHYLATED CYSTEINEA,B2JFA0.78
CCSCARBOXYMETHYLATED CYSTEINEG,R1DSS0.78
CCSCARBOXYMETHYLATED CYSTEINEA,B1L2I0.78
CCSCARBOXYMETHYLATED CYSTEINEA,B,C,D3DMT0.78
CCSCARBOXYMETHYLATED CYSTEINEA,B1ERR0.78
CCSCARBOXYMETHYLATED CYSTEINEA2JX40.78
CAFS-DIMETHYLARSINOYL-CYSTEINEA,B2DYB0.74
CAFS-DIMETHYLARSINOYL-CYSTEINEA1HYV0.74
CAFS-DIMETHYLARSINOYL-CYSTEINEA,B,C,D2C7V0.74
CAFS-DIMETHYLARSINOYL-CYSTEINEA1SNG0.74
CAFS-DIMETHYLARSINOYL-CYSTEINEA2IWR0.74
CAFS-DIMETHYLARSINOYL-CYSTEINEA2FAU0.74
CAFS-DIMETHYLARSINOYL-CYSTEINEA1HYZ0.74
CAFS-DIMETHYLARSINOYL-CYSTEINEA3F7D0.74
CMTO-METHYLCYSTEINEG1OMW0.73
CMTO-METHYLCYSTEINEA,G3CIK0.73
CMTO-METHYLCYSTEINEA1DOA0.73
CBHS-(D-CARBOXYBUTYL)-L-HOMOCYSTEINEA,B1LT80.78
CASS-(DIMETHYLARSENIC)CYSTEINEA,B3G2F0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA,B1FU10.74
CASS-(DIMETHYLARSENIC)CYSTEINEA2IM20.74
CASS-(DIMETHYLARSENIC)CYSTEINEA,B2CJW0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA,B2JBH0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA1JQ60.74
CASS-(DIMETHYLARSENIC)CYSTEINEB2HZE0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA2IM30.74
CASS-(DIMETHYLARSENIC)CYSTEINEA2H790.74
CASS-(DIMETHYLARSENIC)CYSTEINEA2ILZ0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA2IM10.74
CASS-(DIMETHYLARSENIC)CYSTEINEA1RA60.74
CASS-(DIMETHYLARSENIC)CYSTEINEA1TQL0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA2RA80.74
CASS-(DIMETHYLARSENIC)CYSTEINEA,B1I830.74
CASS-(DIMETHYLARSENIC)CYSTEINEA,B3E7S0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA,B1ZZS0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA2ILY0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA2IM00.74
CASS-(DIMETHYLARSENIC)CYSTEINEX3GWS0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA,B2W9J0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA,B1ZZT0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA2H770.74
CASS-(DIMETHYLARSENIC)CYSTEINEA1FYX0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA,B2HMH0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA1BHL0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA,B,C1FF30.74
CASS-(DIMETHYLARSENIC)CYSTEINEA1R4X0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA1S6C0.74
CASS-(DIMETHYLARSENIC)CYSTEINEA1RA70.74
CASS-(DIMETHYLARSENIC)CYSTEINEA,B3ET60.74
CASS-(DIMETHYLARSENIC)CYSTEINEA1FYW0.74
BSC(S)-2-AMINO-4-(AMINO-BUTYLHYDROSULFINYL)BUTANOIC ACIDA,B,C,D,E,F,
G,H
2GWC0.82
CSAS-ACETONYLCYSTEINEA,B1DWQ0.79
CY4S-BUTYRYL-CYSTEINA,B,C,D1M4T0.84
2FMS-(DIFLUOROMETHYL)HOMOCYSTEINEA1PFV0.76
DVAD-VALINEA,B,C,D1C4D0.71
DVAD-VALINEA,B,C,D3BOG0.71
DVAD-VALINEA,B,C,D1GMK0.71
DVAD-VALINEA209D0.71
DVAD-VALINEA,B1TKQ0.71
DVAD-VALINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T,U,V,W,X
1UNJ0.71
DVAD-VALINEA,B1MIC0.71
DVAD-VALINEA,B1NRU0.71
DVAD-VALINEA1DSD0.71
DVAD-VALINEB1L1V0.71
DVAD-VALINEA,B1JNO0.71
DVAD-VALINEA,B1NRM0.71
DVAD-VALINEA,B1NT50.71
DVAD-VALINEA2JUE0.71
DVAD-VALINEA,B,C,D1AV20.71
DVAD-VALINEA,B2FCN0.71
DVAD-VALINEA,B1A7Z0.71
DVAD-VALINEA,B1AL40.71
DVAD-VALINEA,B1NG80.71
DVAD-VALINEA2D550.71
DVAD-VALINEA1DSC0.71
DVAD-VALINEA,B1ALX0.71
DVAD-VALINEA,B1JO40.71
DVAD-VALINEA,B1MAG0.71
DVAD-VALINEA,B1NT60.71
DVAD-VALINEA,B2Q330.71
DVAD-VALINEA,B1JO30.71
DVAD-VALINEC,D1MNV0.71
DVAD-VALINEA,B1KQE0.71
DVAD-VALINEA,B,C,D1W5U0.71
DVAD-VALINEA,B,C,D2IZQ0.71
DVAD-VALINEA,B,C,D,E,F1UNM0.71
DVAD-VALINEA,C,D1S4V0.71
DVAD-VALINEA,B1OVF0.71
DVAD-VALINEA,L1ZEA0.71
DVAD-VALINEA,B1ALZ0.71
DVAD-VALINEA,B,C1A7Y0.71
DVAD-VALINEA,B173D0.71
DVAD-VALINEA,B1BDW0.71
DVAD-VALINEA,B1FJA0.71
DVAD-VALINEA1BFW0.71
DVAD-VALINEA,B,C,D1I3W0.71
DVAD-VALINEA316D0.71
DVAD-VALINEA,B,C1QFI0.71
DVAD-VALINEA,B1GRM0.71