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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02808527

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1ZN(2S,3S,4E,6E,8S,9S)-3-amino-9-methoxy-
2,6,8-trimethyl-10-phenyldeca-4,6-
dienoic acid
C,F,M,N2IAE0.7
PPNPARA-NITROPHENYLALANINEI1YTJ0.76
PHLL-PHENYLALANINOLA,B1JOH0.71
PHLL-PHENYLALANINOLI3APR0.71
PHLL-PHENYLALANINOLA1DLZ0.71
PHLL-PHENYLALANINOLA1IH90.71
PHLL-PHENYLALANINOLA1OB40.71
PHLL-PHENYLALANINOLI2ER60.71
PHLL-PHENYLALANINOLA1R9U0.71
PHLL-PHENYLALANINOLA1OB70.71
PHLL-PHENYLALANINOLA,B1OB60.71
PHLL-PHENYLALANINOLA,B,C1AMT0.71
HPHPHENYLALANINDIOLI1E5O0.72
HPHPHENYLALANINDIOLA,B1ODX0.72
HPHPHENYLALANINDIOLA,B1MTB0.72
HPHPHENYLALANINDIOLA,B2FGV0.72
HPHPHENYLALANINDIOLA1ODW0.72
HPHPHENYLALANINDIOLA,B2FGU0.72
HPHPHENYLALANINDIOLA,B1HXB0.72
KYNKYNURENINEA,B,C,D2R2N0.71
KYNKYNURENINEA,B3E2Z0.71
KYNKYNURENINEA1XT70.71
KYNKYNURENINEA1T5M0.71
KYNKYNURENINEA1T5N0.71
KYNKYNURENINEA2VOV0.71
KYNKYNURENINEA2VOX0.71
APD3-METHYLPHENYLALANINEA,B,C1GMY0.81
APAAMIDO PHENYL PYRUVIC ACIDH,I1AHT0.7
APAAMIDO PHENYL PYRUVIC ACIDA,B,C,D1A0L0.7
APAAMIDO PHENYL PYRUVIC ACIDA1TPP0.7
PFF4-FLUORO-L-PHENYLALANINEA3F3C0.81
PFF4-FLUORO-L-PHENYLALANINEA,C,E,F2UUE0.81
PFF4-FLUORO-L-PHENYLALANINEA1ZNT0.81
PFF4-FLUORO-L-PHENYLALANINEF,H1OL10.81
PFF4-FLUORO-L-PHENYLALANINEA,C,F,H2C5V0.81
PFF4-FLUORO-L-PHENYLALANINEE,F1OL20.81
PCSPHENYLALANYLMETHYLCHLORIDEB,D1DLK0.7
PCSPHENYLALANYLMETHYLCHLORIDEA1XQX0.7
APMM-AMIDINOPHENYL-3-ALANINEE1PPH0.77
MCG(S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINEA,B1ISS0.7
PSA3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACIDI1EPL0.79
PSA3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACIDA,B,C,D2IFW0.79
PSA3-HYDROXY-4-AMINO-5-PHENYLPENTANOIC ACIDE,I1EPM0.79
5PV5-PHENYLVALERIC ACIDA,B2AY90.7
PDH(2S)-2-AMINO-3-PHENYL-1-PROPANOLA1GQ00.71
HPQHOMOPHENYLALANINYLMETHANEB1EWP0.74
MPQN-METHYL-ALPHA-PHENYL-GLYCINED1D6E0.77
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
A,L,M3FEA0.76
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
P1CWD0.76
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
L3FE70.76
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
B2GV20.76
PM32-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)-
PROPIONIC ACID
B,D1CWE0.76
FOG(4S,5S)-5-amino-4-hydroxy-6-phenylhexanoic acidI1EED0.75
DTYD-TYROSINEA1C4B0.71
DTYD-TYROSINEA,L1ZEA0.71
DTYD-TYROSINEA,B,C,D,E,F,
G,H
1OF60.71
DTYD-TYROSINEA,B1UNO0.71
DTYD-TYROSINEA2IGZ0.71
DTYD-TYROSINEA,B,C,H,K,L2R5D0.71
DTYD-TYROSINEA,B2Q330.71
DTYD-TYROSINEH,S2H9E0.71
DTYD-TYROSINEA,B,C,H,K,L2R5B0.71
DTYD-TYROSINEA2IH00.71
DTYD-TYROSINEA1D7T0.71
DTYD-TYROSINEA,B1XA00.71
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY50.78
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY80.78
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY90.78
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XXZ0.78
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY40.78
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY60.78
PRQ(3S)-3-amino-3-(2-nitrophenyl)propanoic acidC,F,I,L2VE60.73
LLG2-aminoethyl naphthalen-1-ylacetateA3BC40.71
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA1DSR0.71
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.71
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.71
23N(2R)-2-benzyl-3-nitropropanoic acidA2RFH0.74
NALBETA-(2-NAPHTHYL)-ALANINEA,B2ITK0.76
NALBETA-(2-NAPHTHYL)-ALANINEH,I4THN0.76
NALBETA-(2-NAPHTHYL)-ALANINEA,B2Q5A0.76
NALBETA-(2-NAPHTHYL)-ALANINEA1ZWU0.76
NALBETA-(2-NAPHTHYL)-ALANINEA1SKL0.76
NALBETA-(2-NAPHTHYL)-ALANINEH,I5GDS0.76
NALBETA-(2-NAPHTHYL)-ALANINEA1ZH00.76
NALBETA-(2-NAPHTHYL)-ALANINEA,B2JT90.76
BR46-PHENYL-4(R)-(7-PHENYL-HEPTANOYLAMINO)-
HEXANOIC ACID
A1KQU0.76
IPOPARA-IODO-D-PHENYLALANINE HYDROXAMIC ACIDA1IGB0.75
CLT4-PHENYL-BUTANOIC ACIDA1THL0.72
CLT4-PHENYL-BUTANOIC ACIDA,B2AY70.72
CLT4-PHENYL-BUTANOIC ACIDE,I1TMN0.72
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J2FIV0.78
ALNNAPHTHALEN-2-YL-3-ALANINEA,B1B0H0.78
ALNNAPHTHALEN-2-YL-3-ALANINEB1FIV0.78
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J3FIV0.78
INFD-[(N-HYDROXYAMINO)CARBONYL]PHENYLALANINEA1HDQ0.75
FRFPHE-REDUCED-PHEA,I1GVX0.74
PHIIODO-PHENYLALANINEA1TF90.81
PHIIODO-PHENYLALANINEA,B,C,D1ORW0.81
PHIIODO-PHENYLALANINEA1T6H0.81
PHIIODO-PHENYLALANINEA,B,C1NLU0.81
PHIIODO-PHENYLALANINEA,I1GA10.81
PHIIODO-PHENYLALANINEA,I1GA40.81
PHIIODO-PHENYLALANINEP1CZI0.81
EAB(3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACIDA,B2H3T0.72
4AF4-ACETYL-L-PHENYLALANINEA1ZH60.75
4BF4-BROMO-L-PHENYLALANINEA2AG60.76
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA3HF00.72
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA2OXK0.72
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA,B,C2OXJ0.72
TFQ4-(2,2,2-TRIFLUOROETHYL)-L-PHENYLALANINEA3D6V0.79
ZAEN-methyl-D-phenylalanineH,I,R1TBZ0.78
INGD-[(AMINO)CARBONYL]PHENYLALANINEA,B1UF80.74
INGD-[(AMINO)CARBONYL]PHENYLALANINEA,B,D,E1HDU0.74
SMF4-SULFOMETHYL-L-PHENYLALANINED,H1O0D0.73
SMF4-SULFOMETHYL-L-PHENYLALANINED,H2FES0.73
SMF4-SULFOMETHYL-L-PHENYLALANINEH,P2ANK0.73
SMF4-SULFOMETHYL-L-PHENYLALANINED,H2FEQ0.73
SMF4-SULFOMETHYL-L-PHENYLALANINEH,P2A2X0.73
SMF4-SULFOMETHYL-L-PHENYLALANINED,H1NZQ0.73
ZAB(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACIDA,B2H3S0.72
ZAB(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACIDA,B,C,D2H4B0.72
PBFPARA-(BENZOYL)-PHENYLALANINEA2FR90.75
PBFPARA-(BENZOYL)-PHENYLALANINEA,B1EEN0.75
PBFPARA-(BENZOYL)-PHENYLALANINEA2HGZ0.75
PBFPARA-(BENZOYL)-PHENYLALANINEA2FRB0.75
T114-[3-(TRIFLUOROMETHYL)DIAZIRIDIN-
3-YL]-L-PHENYLALANINE
A3D6U0.74
PHMPHENYLALANYLMETHANEA,I1PJP0.75
PHMPHENYLALANYLMETHANEA,B,C2J9J0.75
PHMPHENYLALANYLMETHANEA,B,C2JE40.75
LHYL-[(N-HYDROXYAMINO)CARBONYL]PHENYLALANINEA,B,D,E1HEE0.75
PHAPHENYLALANINALA,B1OB20.75
PHAPHENYLALANINALV,Y,Z2WDG0.75
PHAPHENYLALANINALV,Y,Z2WDK0.75
PHAPHENYLALANINAL1,2,4,5,A,B,
C,D,E,J,K,L,
M,N,O,P,R,S,
T,U,V,Z
1M900.75
PHAPHENYLALANINALP3SGA0.75
PHAPHENYLALANINALA,B,C,D,E,F1OB50.75
PHAPHENYLALANINALV,Y,Z2WDM0.75
PHAPHENYLALANINAL0,2,4,9,A,B,
C,H,I,J,K,L,
M,N,P,Q,R,S,
T,X,Y,Z
1KQS0.75
PHAPHENYLALANINALA,B1KDV0.75
PHAPHENYLALANINAL1,2,4,5,6,A,
B,C,D,E,J,K,
L,M,N,O,P,R,
S,T,U,V,Z
1Q860.75
PHAPHENYLALANINALA,B1KDY0.75
PHAPHENYLALANINALV,Y,Z3FIC0.75
PHAPHENYLALANINALV,Y,Z2WDH0.75
PHAPHENYLALANINALA,B1KE20.75
4PH4-methyl-L-phenylalanineB,C3BV90.81
MEAN-METHYLPHENYLALANINEA2PIL0.78
MEAN-METHYLPHENYLALANINEA,B,C,D1H0I0.78
MEAN-METHYLPHENYLALANINEA,B,I1DOJ0.78
HMF2-AMINO-4-PHENYL-BUTYRIC ACIDI,J1AY60.83
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A,B,M,N1FJM0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVA0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1LCM0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A,B,C,D,E,F,
G,H
2NYM0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
C,I2IE30.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
C,F,X,Y2NPP0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVC0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
C,F,G,H3DW80.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A,B,C,D,E,F,
G,H
2NYL0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVD0.73
ADD2,6,8-TRIMETHYL-3-AMINO-9-BENZYL-
9-METHOXYNONANOIC ACID
A1EVB0.73
IGLALPHA-AMINO-2-INDANACETIC ACIDA1BDK0.77
FCL3-CHLORO-L-PHENYLALANINEE,F1OKW0.76
HPEHOMOPHENYLALANINEA,B1B1H0.83
IOYP-IODO-D-PHENYLALANINEA1XBU0.81
0A9methyl L-phenylalaninateA1AY20.83
0A9methyl L-phenylalaninateI5ER10.83
0A9methyl L-phenylalaninateI,P1HDT0.83
NHL(4S)-4-(2-NAPHTHYLMETHYL)-D-GLUTAMIC ACIDA2OHV0.73
2004-CHLORO-L-PHENYLALANINEA,B2AKW0.76
MFD(2S,3S,8S,9S)-3-AMINO-9-METHOXY-
2,6,8-TRIMETHYL-10-PHENYLDECA-4,6-
DIENOIC ACID
A1AY30.7
HPIN-(1-CARBOXY-3-PHENYLPROPYL)PHENYLALANYL-
ALPHA-ASPARAGINE
A1U4G0.71
APHP-AMIDINOPHENYL-3-ALANINEE,I1PPC0.77
APHP-AMIDINOPHENYL-3-ALANINEH1ETS0.77
APHP-AMIDINOPHENYL-3-ALANINEH1ETT0.77
APHP-AMIDINOPHENYL-3-ALANINEI1QUR0.77
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.71
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.71
AHC4-AMINOHYDROCINNAMIC ACIDA,B2AY10.76
HCIHYDROCINNAMIC ACIDA,B1BXG0.71
HCIHYDROCINNAMIC ACIDA,B1TOG0.71
HCIHYDROCINNAMIC ACIDA,B1V2F0.71
HCIHYDROCINNAMIC ACIDA,B1AHX0.71
HCIHYDROCINNAMIC ACIDA1TOI0.71
HCIHYDROCINNAMIC ACIDA,B1AY80.71
HCIHYDROCINNAMIC ACIDA1TOJ0.71
1PAPHENYLMETHYLACETIC ACID ALANINEI1BHF0.79
DPND-PHENYLALANINEP1MCS0.83
DPND-PHENYLALANINEA1GOE0.83
DPND-PHENYLALANINEA2RM90.83
DPND-PHENYLALANINEA1SOC0.83
DPND-PHENYLALANINEB,C,E,F1SFQ0.83
DPND-PHENYLALANINEI1ABJ0.83
DPND-PHENYLALANINEP1DWE0.83
DPND-PHENYLALANINEI,M1HLT0.83
DPND-PHENYLALANINEA,H,L1J9C0.83
DPND-PHENYLALANINEI,T1TMB0.83
DPND-PHENYLALANINEA2JRY0.83
DPND-PHENYLALANINEA2SOC0.83
DPND-PHENYLALANINEA2YYF0.83
DPND-PHENYLALANINEI2HGT0.83
DPND-PHENYLALANINEA,D2Q3I0.83
DPND-PHENYLALANINEA,P1MCD0.83
DPND-PHENYLALANINEP1HAO0.83
DPND-PHENYLALANINEA,B,I1Z8J0.83
DPND-PHENYLALANINEA,B,C2PGQ0.83
DPND-PHENYLALANINEC,D,H,I,L,M,
X,Y
1DVA0.83
DPND-PHENYLALANINEP1NRR0.83
DPND-PHENYLALANINEI1PPB0.83
DPND-PHENYLALANINEC,D,G,H1NU70.83
DPND-PHENYLALANINEI2HPP0.83
DPND-PHENYLALANINEB,C2OD30.83
DPND-PHENYLALANINEA1B0Q0.83
DPND-PHENYLALANINEB,C,E,F1NU90.83
DPND-PHENYLALANINEA,B,I1Z8I0.83
DPND-PHENYLALANINEH,I,J1TMU0.83
DPND-PHENYLALANINEA,B,C,D,E,F2DNS0.83
DPND-PHENYLALANINEA1GO90.83
DPND-PHENYLALANINEB,C,E,F1A0H0.83
DPND-PHENYLALANINEP1MCF0.83
DPND-PHENYLALANINEA2RME0.83
DPND-PHENYLALANINEH,I1TMT0.83
DPND-PHENYLALANINEI1ABI0.83
DPND-PHENYLALANINER1NRQ0.83
DPND-PHENYLALANINEB,C,F,G2A1D0.83
DPND-PHENYLALANINEA,B2Q330.83
DPND-PHENYLALANINEC,H,L1DAN0.83
DPND-PHENYLALANINEP1MCE0.83
DPND-PHENYLALANINEB,C,E,F2A450.83
DPND-PHENYLALANINEA2RMI0.83
DPND-PHENYLALANINEA,B,I1TQ70.83
DPND-PHENYLALANINEA1W7M0.83
DPND-PHENYLALANINEP1HAP0.83
DPND-PHENYLALANINEA,B1ORF0.83
DPND-PHENYLALANINEI1IHS0.83
DPND-PHENYLALANINEP1MCC0.83
DPND-PHENYLALANINEA2RMD0.83
DPND-PHENYLALANINEA2JQB0.83
DPND-PHENYLALANINEI2HPQ0.83
DPND-PHENYLALANINEC,E,F1SHH0.83
DPND-PHENYLALANINEA,I1CVR0.83
DPND-PHENYLALANINEL,P1AUT0.83
DPND-PHENYLALANINEP1MCI0.83
DPND-PHENYLALANINEH,I3F6U0.83
DPND-PHENYLALANINEA1BFW0.83
DPND-PHENYLALANINEH,I1HAI0.83
DPND-PHENYLALANINEB,C2THF0.83
DPND-PHENYLALANINEI1IHT0.83
DPND-PHENYLALANINEA,P1MCJ0.83
DPND-PHENYLALANINEA1TKH0.83
DPND-PHENYLALANINEC,H,L,T2FIR0.83
DPND-PHENYLALANINEA2FMZ0.83
DPND-PHENYLALANINEA1YL90.83
DPND-PHENYLALANINEI1HUT0.83
DPND-PHENYLALANINEI1FXY0.83
DPND-PHENYLALANINEA1YL80.83
DPND-PHENYLALANINEC,H,L1QFK0.83
DPND-PHENYLALANINEP1MCB0.83
MTYMETA-TYROSINEA2TOH0.71
MTYMETA-TYROSINEA,B1BIQ0.71
MTYMETA-TYROSINEA1Q7O0.71
NPGN-SUCCINYL PHENYLGLYCINEA,B,C,D1SJD0.75
GHP4-HYDROXYPHENYLGLYCINEA1DSR0.71
TA2(2R,3S)-3-AMINO-3-PHENYLPROPANE-
1,2-DIOL
A,B2IFR0.7
PG9D-PHENYLGLYCINEA,B,G,H10GS0.83
PG9D-PHENYLGLYCINEA,B,C,D2B4K0.83
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S1YYL0.8
BIF(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACIDG,M,P,S2I5Y0.8
FTYDEOXY-DIFLUOROMETHELENE-PHOSPHOTYROSINEC,D1A080.74
FTYDEOXY-DIFLUOROMETHELENE-PHOSPHOTYROSINEC,D,E,F1QZ00.74
FTYDEOXY-DIFLUOROMETHELENE-PHOSPHOTYROSINEC,D,E,F1XXV0.74
NFAPHENYLALANINE AMIDEA,B,C,D2BTJ0.75
NFAPHENYLALANINE AMIDEA,B,C,D,E,F2EFX0.75
NFAPHENYLALANINE AMIDEA,B,C,D2VVJ0.75
NFAPHENYLALANINE AMIDEA2A4O0.75
NFAPHENYLALANINE AMIDEA,B1XAE0.75
NFAPHENYLALANINE AMIDEA,B,C,D2OGR0.75
NFAPHENYLALANINE AMIDEA,B,C,D1QA70.75
NFAPHENYLALANINE AMIDEA,B,C,D2GW40.75
CXAPHENYLALANINE-N-SULFONAMIDEA1IY70.79
NDFN-(CARBOXYCARBONYL)-D-PHENYLALANINEA1YCI0.73
PF52,3,4,5,6-PENTAFLUORO-L-PHENYLALANINEA2JM00.73
BEY(2S)-3-[(R)-[(1S)-1-amino-3-phenylpropyl](hydroxy)phosphoryl]-
2-benzylpropanoic acid
A3EBI0.72
KELN-[(2R)-2-benzyl-4-(hydroxyamino)-
4-oxobutanoyl]-L-alanine
X3B7U0.7