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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02248187

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2BL(3R)-3-ethyl-N-[(4-methylphenyl)sulfonyl]-
L-aspartic acid
A1BTU0.79
APD3-METHYLPHENYLALANINEA,B,C1GMY0.71
PBBS-(4-BROMOBENZYL)CYSTEINEA,B,C,D1AQV0.78
SMF4-SULFOMETHYL-L-PHENYLALANINED,H1O0D0.78
SMF4-SULFOMETHYL-L-PHENYLALANINED,H2FES0.78
SMF4-SULFOMETHYL-L-PHENYLALANINEH,P2ANK0.78
SMF4-SULFOMETHYL-L-PHENYLALANINED,H2FEQ0.78
SMF4-SULFOMETHYL-L-PHENYLALANINEH,P2A2X0.78
SMF4-SULFOMETHYL-L-PHENYLALANINED,H1NZQ0.78
CXAPHENYLALANINE-N-SULFONAMIDEA1IY70.74
CPMS-(2-CARBOXY-3-PHENYLPROPYL)THIODIIMINE-
S-METHANE
A1CPS0.7
TPRTOSYL-D-PROLINEA1F4E0.7
0A9methyl L-phenylalaninateA1AY20.72
0A9methyl L-phenylalaninateI5ER10.72
0A9methyl L-phenylalaninateI,P1HDT0.72
BDLN-(biphenyl-4-ylsulfonyl)-D-leucineA3EHX0.77
FBDN-({(1R)-1-carboxy-2-[(4-fluorobenzyl)sulfanyl]ethyl}carbamoyl)-
L-glutamic acid
A3D7D0.71
4PH4-methyl-L-phenylalanineB,C3BV90.71
GSBS-BENZYL-GLUTATHIONEA,B,C,D1FRO0.72
GSBS-BENZYL-GLUTATHIONEA,B,C,D1GUH0.72
DSVN-(dibenzo[b,d]thiophen-3-ylsulfonyl)-
L-valine
A2K2G0.72
DPND-PHENYLALANINEP1MCS0.71
DPND-PHENYLALANINEA1GOE0.71
DPND-PHENYLALANINEA2RM90.71
DPND-PHENYLALANINEA1SOC0.71
DPND-PHENYLALANINEB,C,E,F1SFQ0.71
DPND-PHENYLALANINEI1ABJ0.71
DPND-PHENYLALANINEP1DWE0.71
DPND-PHENYLALANINEI,M1HLT0.71
DPND-PHENYLALANINEA,H,L1J9C0.71
DPND-PHENYLALANINEI,T1TMB0.71
DPND-PHENYLALANINEA2JRY0.71
DPND-PHENYLALANINEA2SOC0.71
DPND-PHENYLALANINEA2YYF0.71
DPND-PHENYLALANINEI2HGT0.71
DPND-PHENYLALANINEA,D2Q3I0.71
DPND-PHENYLALANINEA,P1MCD0.71
DPND-PHENYLALANINEP1HAO0.71
DPND-PHENYLALANINEA,B,I1Z8J0.71
DPND-PHENYLALANINEA,B,C2PGQ0.71
DPND-PHENYLALANINEC,D,H,I,L,M,
X,Y
1DVA0.71
DPND-PHENYLALANINEP1NRR0.71
DPND-PHENYLALANINEI1PPB0.71
DPND-PHENYLALANINEC,D,G,H1NU70.71
DPND-PHENYLALANINEI2HPP0.71
DPND-PHENYLALANINEB,C2OD30.71
DPND-PHENYLALANINEA1B0Q0.71
DPND-PHENYLALANINEB,C,E,F1NU90.71
DPND-PHENYLALANINEA,B,I1Z8I0.71
DPND-PHENYLALANINEH,I,J1TMU0.71
DPND-PHENYLALANINEA,B,C,D,E,F2DNS0.71
DPND-PHENYLALANINEA1GO90.71
DPND-PHENYLALANINEB,C,E,F1A0H0.71
DPND-PHENYLALANINEP1MCF0.71
DPND-PHENYLALANINEA2RME0.71
DPND-PHENYLALANINEH,I1TMT0.71
DPND-PHENYLALANINEI1ABI0.71
DPND-PHENYLALANINER1NRQ0.71
DPND-PHENYLALANINEB,C,F,G2A1D0.71
DPND-PHENYLALANINEA,B2Q330.71
DPND-PHENYLALANINEC,H,L1DAN0.71
DPND-PHENYLALANINEP1MCE0.71
DPND-PHENYLALANINEB,C,E,F2A450.71
DPND-PHENYLALANINEA2RMI0.71
DPND-PHENYLALANINEA,B,I1TQ70.71
DPND-PHENYLALANINEA1W7M0.71
DPND-PHENYLALANINEP1HAP0.71
DPND-PHENYLALANINEA,B1ORF0.71
DPND-PHENYLALANINEI1IHS0.71
DPND-PHENYLALANINEP1MCC0.71
DPND-PHENYLALANINEA2RMD0.71
DPND-PHENYLALANINEA2JQB0.71
DPND-PHENYLALANINEI2HPQ0.71
DPND-PHENYLALANINEC,E,F1SHH0.71
DPND-PHENYLALANINEA,I1CVR0.71
DPND-PHENYLALANINEL,P1AUT0.71
DPND-PHENYLALANINEP1MCI0.71
DPND-PHENYLALANINEH,I3F6U0.71
DPND-PHENYLALANINEA1BFW0.71
DPND-PHENYLALANINEH,I1HAI0.71
DPND-PHENYLALANINEB,C2THF0.71
DPND-PHENYLALANINEI1IHT0.71
DPND-PHENYLALANINEA,P1MCJ0.71
DPND-PHENYLALANINEA1TKH0.71
DPND-PHENYLALANINEC,H,L,T2FIR0.71
DPND-PHENYLALANINEA2FMZ0.71
DPND-PHENYLALANINEA1YL90.71
DPND-PHENYLALANINEI1HUT0.71
DPND-PHENYLALANINEI1FXY0.71
DPND-PHENYLALANINEA1YL80.71
DPND-PHENYLALANINEC,H,L1QFK0.71
DPND-PHENYLALANINEP1MCB0.71
TCKN-[(1S)-5-amino-1-(chloroacetyl)pentyl]-
4-methylbenzenesulfonamide
A1ARC0.7
SEBO-BENZYLSULFONYL-SERINEA,B,C,D2APJ0.82
SEBO-BENZYLSULFONYL-SERINEA1IAV0.82
SEBO-BENZYLSULFONYL-SERINEA,B1IEC0.82
SEBO-BENZYLSULFONYL-SERINEA1ZIY0.82
SEBO-BENZYLSULFONYL-SERINEA1C9N0.82
SEBO-BENZYLSULFONYL-SERINEA1ZJ40.82
SEBO-BENZYLSULFONYL-SERINEA1GGV0.82
SEBO-BENZYLSULFONYL-SERINEA1Q5P0.82
SEBO-BENZYLSULFONYL-SERINEA1PQA0.82
SEBO-BENZYLSULFONYL-SERINEA1ZJ50.82
SEBO-BENZYLSULFONYL-SERINEA1C9M0.82
BCSBENZYLCYSTEINEA,B,G,H10GS0.86
BCSBENZYLCYSTEINEA1EH80.86
R1F3-{[(2,2,5,5-TETRAMETHYL-1-OXO-
4-PHENYL-2,5-DIHYDRO-1H-PYRROLIUM-
3-YL)METHYL]DISULFANYL}-D-ALANINE
A1ZUR0.72
HMF2-AMINO-4-PHENYL-BUTYRIC ACIDI,J1AY60.71
HPEHOMOPHENYLALANINEA,B1B1H0.71