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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00052065

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CLBD-PARA-CHLOROPHENYL-1-ACETAMIDOBORONIC ACID ALANINEA1VSB0.71
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J2FIV0.73
ALNNAPHTHALEN-2-YL-3-ALANINEA,B1B0H0.73
ALNNAPHTHALEN-2-YL-3-ALANINEB1FIV0.73
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J3FIV0.73
APHP-AMIDINOPHENYL-3-ALANINEE,I1PPC0.71
APHP-AMIDINOPHENYL-3-ALANINEH1ETS0.71
APHP-AMIDINOPHENYL-3-ALANINEH1ETT0.71
APHP-AMIDINOPHENYL-3-ALANINEI1QUR0.71
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S1YYL0.77
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S2I5Y0.77
2004-CHLORO-L-PHENYLALANINEA,B2AKW0.91
APD3-METHYLPHENYLALANINEA,B,C1GMY0.79
CHP3-CHLORO-4-HYDROXYPHENYLGLYCINEA1DSR0.72
CXAPHENYLALANINE-N-SULFONAMIDEA1IY70.78
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.77
4AF4-ACETYL-L-PHENYLALANINEA1ZH60.74
APF1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN-
2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)
B,C1GG60.7
APF1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN-
2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)
G6GCH0.7
4BF4-BROMO-L-PHENYLALANINEA2AG60.75
4PH4-methyl-L-phenylalanineB,C3BV90.79
APMM-AMIDINOPHENYL-3-ALANINEE1PPH0.71
DTYD-TYROSINEA1C4B0.7
DTYD-TYROSINEA,L1ZEA0.7
DTYD-TYROSINEA,B,C,D,E,F,
G,H
1OF60.7
DTYD-TYROSINEA,B1UNO0.7
DTYD-TYROSINEA2IGZ0.7
DTYD-TYROSINEA,B,C,H,K,L2R5D0.7
DTYD-TYROSINEA,B2Q330.7
DTYD-TYROSINEH,S2H9E0.7
DTYD-TYROSINEA,B,C,H,K,L2R5B0.7
DTYD-TYROSINEA2IH00.7
DTYD-TYROSINEA1D7T0.7
DTYD-TYROSINEA,B1XA00.7
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.73
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.73
DPND-PHENYLALANINEP1MCS0.82
DPND-PHENYLALANINEA1GOE0.82
DPND-PHENYLALANINEA2RM90.82
DPND-PHENYLALANINEA1SOC0.82
DPND-PHENYLALANINEB,C,E,F1SFQ0.82
DPND-PHENYLALANINEI1ABJ0.82
DPND-PHENYLALANINEP1DWE0.82
DPND-PHENYLALANINEI,M1HLT0.82
DPND-PHENYLALANINEA,H,L1J9C0.82
DPND-PHENYLALANINEI,T1TMB0.82
DPND-PHENYLALANINEA2JRY0.82
DPND-PHENYLALANINEA2SOC0.82
DPND-PHENYLALANINEA2YYF0.82
DPND-PHENYLALANINEI2HGT0.82
DPND-PHENYLALANINEA,D2Q3I0.82
DPND-PHENYLALANINEA,P1MCD0.82
DPND-PHENYLALANINEP1HAO0.82
DPND-PHENYLALANINEA,B,I1Z8J0.82
DPND-PHENYLALANINEA,B,C2PGQ0.82
DPND-PHENYLALANINEC,D,H,I,L,M,
X,Y
1DVA0.82
DPND-PHENYLALANINEP1NRR0.82
DPND-PHENYLALANINEI1PPB0.82
DPND-PHENYLALANINEC,D,G,H1NU70.82
DPND-PHENYLALANINEI2HPP0.82
DPND-PHENYLALANINEB,C2OD30.82
DPND-PHENYLALANINEA1B0Q0.82
DPND-PHENYLALANINEB,C,E,F1NU90.82
DPND-PHENYLALANINEA,B,I1Z8I0.82
DPND-PHENYLALANINEH,I,J1TMU0.82
DPND-PHENYLALANINEA,B,C,D,E,F2DNS0.82
DPND-PHENYLALANINEA1GO90.82
DPND-PHENYLALANINEB,C,E,F1A0H0.82
DPND-PHENYLALANINEP1MCF0.82
DPND-PHENYLALANINEA2RME0.82
DPND-PHENYLALANINEH,I1TMT0.82
DPND-PHENYLALANINEI1ABI0.82
DPND-PHENYLALANINER1NRQ0.82
DPND-PHENYLALANINEB,C,F,G2A1D0.82
DPND-PHENYLALANINEA,B2Q330.82
DPND-PHENYLALANINEC,H,L1DAN0.82
DPND-PHENYLALANINEP1MCE0.82
DPND-PHENYLALANINEB,C,E,F2A450.82
DPND-PHENYLALANINEA2RMI0.82
DPND-PHENYLALANINEA,B,I1TQ70.82
DPND-PHENYLALANINEA1W7M0.82
DPND-PHENYLALANINEP1HAP0.82
DPND-PHENYLALANINEA,B1ORF0.82
DPND-PHENYLALANINEI1IHS0.82
DPND-PHENYLALANINEP1MCC0.82
DPND-PHENYLALANINEA2RMD0.82
DPND-PHENYLALANINEA2JQB0.82
DPND-PHENYLALANINEI2HPQ0.82
DPND-PHENYLALANINEC,E,F1SHH0.82
DPND-PHENYLALANINEA,I1CVR0.82
DPND-PHENYLALANINEL,P1AUT0.82
DPND-PHENYLALANINEP1MCI0.82
DPND-PHENYLALANINEH,I3F6U0.82
DPND-PHENYLALANINEA1BFW0.82
DPND-PHENYLALANINEH,I1HAI0.82
DPND-PHENYLALANINEB,C2THF0.82
DPND-PHENYLALANINEI1IHT0.82
DPND-PHENYLALANINEA,P1MCJ0.82
DPND-PHENYLALANINEA1TKH0.82
DPND-PHENYLALANINEC,H,L,T2FIR0.82
DPND-PHENYLALANINEA2FMZ0.82
DPND-PHENYLALANINEA1YL90.82
DPND-PHENYLALANINEI1HUT0.82
DPND-PHENYLALANINEI1FXY0.82
DPND-PHENYLALANINEA1YL80.82
DPND-PHENYLALANINEC,H,L1QFK0.82
DPND-PHENYLALANINEP1MCB0.82
0A9methyl L-phenylalaninateA1AY20.81
0A9methyl L-phenylalaninateI5ER10.81
0A9methyl L-phenylalaninateI,P1HDT0.81
CNTN-METHYL-META-CHLORO-TYROSINEC,D1OKX0.71
CLDD-PARA-CHLOROPHENYL-1-ACTEAMIDOBORONIC ACID ALANINEA1AVT0.71