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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02475586

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CHGCYCLOHEXYL-GLYCINE2,3,48KME0.8
CHGCYCLOHEXYL-GLYCINEH,I4THN0.8
CHGCYCLOHEXYL-GLYCINEH,I,J7KME0.8
CHGCYCLOHEXYL-GLYCINEH,I5GDS0.8
DPND-PHENYLALANINEP1MCS0.72
DPND-PHENYLALANINEA1GOE0.72
DPND-PHENYLALANINEA2RM90.72
DPND-PHENYLALANINEA1SOC0.72
DPND-PHENYLALANINEB,C,E,F1SFQ0.72
DPND-PHENYLALANINEI1ABJ0.72
DPND-PHENYLALANINEP1DWE0.72
DPND-PHENYLALANINEI,M1HLT0.72
DPND-PHENYLALANINEA,H,L1J9C0.72
DPND-PHENYLALANINEI,T1TMB0.72
DPND-PHENYLALANINEA2JRY0.72
DPND-PHENYLALANINEA2SOC0.72
DPND-PHENYLALANINEA2YYF0.72
DPND-PHENYLALANINEI2HGT0.72
DPND-PHENYLALANINEA,D2Q3I0.72
DPND-PHENYLALANINEA,P1MCD0.72
DPND-PHENYLALANINEP1HAO0.72
DPND-PHENYLALANINEA,B,I1Z8J0.72
DPND-PHENYLALANINEA,B,C2PGQ0.72
DPND-PHENYLALANINEC,D,H,I,L,M,
X,Y
1DVA0.72
DPND-PHENYLALANINEP1NRR0.72
DPND-PHENYLALANINEI1PPB0.72
DPND-PHENYLALANINEC,D,G,H1NU70.72
DPND-PHENYLALANINEI2HPP0.72
DPND-PHENYLALANINEB,C2OD30.72
DPND-PHENYLALANINEA1B0Q0.72
DPND-PHENYLALANINEB,C,E,F1NU90.72
DPND-PHENYLALANINEA,B,I1Z8I0.72
DPND-PHENYLALANINEH,I,J1TMU0.72
DPND-PHENYLALANINEA,B,C,D,E,F2DNS0.72
DPND-PHENYLALANINEA1GO90.72
DPND-PHENYLALANINEB,C,E,F1A0H0.72
DPND-PHENYLALANINEP1MCF0.72
DPND-PHENYLALANINEA2RME0.72
DPND-PHENYLALANINEH,I1TMT0.72
DPND-PHENYLALANINEI1ABI0.72
DPND-PHENYLALANINER1NRQ0.72
DPND-PHENYLALANINEB,C,F,G2A1D0.72
DPND-PHENYLALANINEA,B2Q330.72
DPND-PHENYLALANINEC,H,L1DAN0.72
DPND-PHENYLALANINEP1MCE0.72
DPND-PHENYLALANINEB,C,E,F2A450.72
DPND-PHENYLALANINEA2RMI0.72
DPND-PHENYLALANINEA,B,I1TQ70.72
DPND-PHENYLALANINEA1W7M0.72
DPND-PHENYLALANINEP1HAP0.72
DPND-PHENYLALANINEA,B1ORF0.72
DPND-PHENYLALANINEI1IHS0.72
DPND-PHENYLALANINEP1MCC0.72
DPND-PHENYLALANINEA2RMD0.72
DPND-PHENYLALANINEA2JQB0.72
DPND-PHENYLALANINEI2HPQ0.72
DPND-PHENYLALANINEC,E,F1SHH0.72
DPND-PHENYLALANINEA,I1CVR0.72
DPND-PHENYLALANINEL,P1AUT0.72
DPND-PHENYLALANINEP1MCI0.72
DPND-PHENYLALANINEH,I3F6U0.72
DPND-PHENYLALANINEA1BFW0.72
DPND-PHENYLALANINEH,I1HAI0.72
DPND-PHENYLALANINEB,C2THF0.72
DPND-PHENYLALANINEI1IHT0.72
DPND-PHENYLALANINEA,P1MCJ0.72
DPND-PHENYLALANINEA1TKH0.72
DPND-PHENYLALANINEC,H,L,T2FIR0.72
DPND-PHENYLALANINEA2FMZ0.72
DPND-PHENYLALANINEA1YL90.72
DPND-PHENYLALANINEI1HUT0.72
DPND-PHENYLALANINEI1FXY0.72
DPND-PHENYLALANINEA1YL80.72
DPND-PHENYLALANINEC,H,L1QFK0.72
DPND-PHENYLALANINEP1MCB0.72
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B1MIK0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A1CSA0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWL0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A1CYA0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,B,D1MF80.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1BCK0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,B,D,E,F,H1M630.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWC0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWI0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C,D1QNH0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B,D,F,H2RMC0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
T,U,V2POY0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CYN0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C,D2OJU0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B,D,F,H,J,L,
N,P,R,T
2RMA0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A1CYB0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
D1QNG0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B3CYS0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWH0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,B,C,D,E,F,
G,H
3BO70.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,B,C,D,E,F,
I,J,K,L,M,N
2ESL0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1IKF0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
A,M,N2Z6W0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
B,D,F,H,J,L,
N,P
1C5F0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWO0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
D,E,F1XQ70.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWA0.74
BMT4-METHYL-4-[(E)-2-BUTENYL]-4,N-
METHYL-THREONINE
C1CWF0.74
OTY2-AMINO-3-(4-HYDROXY-6-OXOCYCLOHEXA-
1,4-DIENYL)PROPANOIC ACID
A2E2T0.73
OTY2-AMINO-3-(4-HYDROXY-6-OXOCYCLOHEXA-
1,4-DIENYL)PROPANOIC ACID
A3CIW0.73
OTY2-AMINO-3-(4-HYDROXY-6-OXOCYCLOHEXA-
1,4-DIENYL)PROPANOIC ACID
A,B2E2V0.73
OTY2-AMINO-3-(4-HYDROXY-6-OXOCYCLOHEXA-
1,4-DIENYL)PROPANOIC ACID
A,B2E2U0.73
2NPL-2-AMINO-6-METHYLENE-PIMELIC ACIDA,B1F060.76
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1W6C0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1W6G0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,C,D2C100.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1IQX0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,C,D1N9E0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B2CWT0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1IVX0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1IU70.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1JRQ0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1UI80.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1QAF0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1OAC0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1DYU0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1RKY0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,D,E2PNC0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1AV40.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,C,D,E,F2OQE0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1W7C0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A2CFK0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A2CFL0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A2CFW0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A2CG00.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,C,D,E,F2OOV0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1KSI0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1PU40.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1WMO0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B2CFD0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B2CFG0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1WMN0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B2W0Q0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,C,D,E,F1A2V0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B,C,D1W2Z0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A2CG10.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1US10.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1IVW0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1AVL0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1QAK0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1TU50.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A2BT30.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1QAL0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A,B1IQY0.71
TPQ5-(2-CARBOXY-2-AMINOETHYL)-2-HYDROXY-
1,4-BENZOQUINONE
A1RJO0.71
HPEHOMOPHENYLALANINEA,B1B1H0.72
HMF2-AMINO-4-PHENYL-BUTYRIC ACIDI,J1AY60.72
LYRN~6~-[(2Z,4E,6E,8E)-3,7-DIMETHYL-
9-(2,6,6-TRIMETHYLCYCLOHEX-1-EN-
1-YL)NONA-2,4,6,8-TETRAENYL]LYSINE
A,B2J4Y0.76
ACZCIS-AMICLENOMYCINA,B1MLY0.88
DMT3-HYDROXY-4,4-DIMETHYL-2-(METHYLAMINO)-
6-OCTENOIC ACID
B,D,F,H,J,L,
N,P,R,T
2RMB0.71
DMT3-HYDROXY-4,4-DIMETHYL-2-(METHYLAMINO)-
6-OCTENOIC ACID
C1CWB0.71
DPQ(S)-2-AMINO-3-(4-HYDROXY-3-OXOCYCLOHEXA-
1,4-DIENYL)PROPANOIC ACID
A,B2YX90.75
2BH[(1E,5S)-5-AMINO-5-CARBOXYPENT-
1-ENYL](TRIHYDROXY)BORATE(1-)
A,B,C1T4P0.71
TYO(4Z,6E)-2-AMINO-7-HYDROPEROXY-4-
[(E)-2-HYDROXYVINYL]HEPTA-4,6-DIENOIC ACID
A,B2HHF0.7
TZATRANS-AMICLENOMYCINA,B1MLZ0.88
ZAL3-cyclohexyl-D-alanineI1HBT0.79
HHK(2S)-2,8-DIAMINOOCTANOIC ACIDA1XY80.7
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID
A,B1CEB0.71
AMHTRANS-4-AMINOMETHYLCYCLOHEXANE-
1-CARBOXYLIC ACID
A1B2I0.71
GBCGABACULINEA,B,C1GBN0.78
IKT3-(1-AMINOETHYL)NONANEDIOIC ACIDA1DAE0.7
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5Z0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I5GDS0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2A2X0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FEQ0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,P2ANK0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,C,D3DPP0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1EB10.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1NZQ0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1HBT0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D6E0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B1B3H0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H2FES0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDC,D,E,G,H3DPQ0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1THS0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDI1QUR0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D3DPO0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDH,I4THN0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,D1D5M0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD,H1O0D0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1YWH0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDA1XRZ0.79
ALC2-AMINO-3-CYCLOHEXYL-PROPIONIC ACIDD1D5X0.79