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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03003314

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LYN2,6-DIAMINO-HEXANOIC ACID AMIDEA1GEA0.74
ZRGN~2~-acetyl-N-methyl-N~5~-[N-(methylcarbamoyl)carbamimidoyl]-
L-ornithinamide
A,B3CHC0.7
AIO[(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN-
2-YL]BORONIC ACID
A2EEP0.73
AIO[(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN-
2-YL]BORONIC ACID
A2Z3Z0.73
ALYN(6)-ACETYLLYSINEA,B2B4D0.79
ALYN(6)-ACETYLLYSINEA,B2OD90.79
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVR0.79
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVS0.79
ALYN(6)-ACETYLLYSINEA,B,C,P,Q2DVQ0.79
ALYN(6)-ACETYLLYSINEA,B,C,D2OT70.79
ALYN(6)-ACETYLLYSINEA,B2B5G0.79
ALYN(6)-ACETYLLYSINEA2GIV0.79
ALYN(6)-ACETYLLYSINEB2RNY0.79
ALYN(6)-ACETYLLYSINEA1JSP0.79
ALYN(6)-ACETYLLYSINEA,B,I,L2V5W0.79
ALYN(6)-ACETYLLYSINEA,D3D4B0.79
ALYN(6)-ACETYLLYSINEA,B,C,D2OQ60.79
ALYN(6)-ACETYLLYSINEA,B2R0Y0.79
ALYN(6)-ACETYLLYSINEA3CZ70.79
ALYN(6)-ACETYLLYSINEA1JM40.79
ALYN(6)-ACETYLLYSINEA,B2H4H0.79
ALYN(6)-ACETYLLYSINEA,B2J6V0.79
ALYN(6)-ACETYLLYSINEA,B2R100.79
ALYN(6)-ACETYLLYSINEA,B1YC50.79
ALYN(6)-ACETYLLYSINEA,B,C,D2OX00.79
ALYN(6)-ACETYLLYSINEA,B2H2G0.79
ALYN(6)-ACETYLLYSINEA,D2H4F0.79
ALYN(6)-ACETYLLYSINEA2OU20.79
ALYN(6)-ACETYLLYSINEA,B1S5P0.79
ALYN(6)-ACETYLLYSINEB2RNW0.79
ALYN(6)-ACETYLLYSINEA3D350.79
ALYN(6)-ACETYLLYSINEA,B2OD20.79
ALYN(6)-ACETYLLYSINEA2ZFN0.79
ALYN(6)-ACETYLLYSINEC,D2C1J0.79
ALYN(6)-ACETYLLYSINEA,B2QQG0.79
ALYN(6)-ACETYLLYSINEB2RNX0.79
ALYN(6)-ACETYLLYSINEA,B1MA30.79
ALYN(6)-ACETYLLYSINEA,B2H2H0.79
ALYN(6)-ACETYLLYSINEA2I2Z0.79
ALYN(6)-ACETYLLYSINEA,B2OD70.79
ALYN(6)-ACETYLLYSINEP1E6I0.79
ALYN(6)-ACETYLLYSINEA,B1SZC0.79
ALYN(6)-ACETYLLYSINEA,B,C,D,I,J,
K,L
3EWF0.79
ALYN(6)-ACETYLLYSINEA,B2H2D0.79
ALYN(6)-ACETYLLYSINEA,B1Q1A0.79
ALYN(6)-ACETYLLYSINEA,B1SZD0.79
ALYN(6)-ACETYLLYSINEQ,R2E3K0.79
ALYN(6)-ACETYLLYSINEA2OZU0.79
ALYN(6)-ACETYLLYSINEA,B2QQF0.79
ALYN(6)-ACETYLLYSINEA,B,C2R0V0.79
BPR(2R)-N-[(2R)-2-(DIHYDROXYBORYL)-
1-L-PROLYLPYRROLIDIN-2-YL]-N-[(5R)-
5-(DIHYDROXYBORYL)-1-L-PROLYLPYRROLIDIN-
2-YL]-L-PROLINAMIDE
A,B,C,D2AJD0.72
EPQ(4S)-4-amino-6-fluoro-N,N-dimethyl-
5-oxohexanamide
A,I2H6M0.75
EPQ(4S)-4-amino-6-fluoro-N,N-dimethyl-
5-oxohexanamide
A,I2H9H0.75
LDHN~6~-ETHYL-L-LYSINEA,K2IOF0.72
ICCazepan-2-oneA,B2ZUK0.79
FXY1-METHYLHEPTYLFORMAMIDEA,B1U3W0.71
O12N~5~-dodecanoyl-L-ornithineA,B,C,D,E,F,
G,H,I,J,K,L
3CAY0.7
O12N~5~-dodecanoyl-L-ornithineA,B,C,D,E,F,
G,H,I,J,K,L
3CBA0.7
SP5N-[3-({4-[(3-aminopropyl)amino]butyl}amino)propyl]acetamideA,B3CND0.74
SP7N-{(1S)-3-[(4-aminobutyl)amino]-
1-methylpropyl}acetamide
A,B3CNP0.8
LDM3-LAURYLAMIDO-N,N'-DIMETHYLPROPYLAMINOXYDEA1OKC0.78
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B2J9P0.71
REZ(2R)-2-AMINO-7-{[(1R)-1-CARBOXYETHYL]AMINO}-
7-OXOHEPTANOIC ACID
A,B,C,D2VGK0.71
DLSDI-ACETYL-LYSINEA,B,C,D,E,F1FVM0.75
NLNNORLEUCINE AMIDEA1DW60.74
NLNNORLEUCINE AMIDEA,B,C2AOE0.74
NLNNORLEUCINE AMIDEA,B1EBK0.74
140N-PALMITOYLGLYCINEA,B1JPZ0.7
140N-PALMITOYLGLYCINEA,B1ZOA0.7
140N-PALMITOYLGLYCINEA,B3CBD0.7
OHM3-OXO-N-[(3S)-2-OXOPYRROLIDIN-3-
YL]DODECANAMIDE
B,H2NTF0.73
CIB2-ACETYLAMINO-4-METHYL-PENTANOIC ACID [1-
(1-FORMYL-PENTYLCARBAMOYL)-3-METHYL-
BUTYL]-AMIDE
H,I,J,K,L,M,N1J2Q0.75
NMH(R)-N-(1-METHYL-HEXYL)-FORMAMIDEA,B,C,D1P1R0.73
KCQ(3S)-3-[(2S)-2-AMINO-3-OXOBUTYL]PYRROLIDIN-
2-ONE
A,I2Z3E0.72
PPLPIPERIDINE-2-CARBOXYLIC ACID TERT-
BUTYLAMIDE
A,B1IDB0.8
PPLPIPERIDINE-2-CARBOXYLIC ACID TERT-
BUTYLAMIDE
A,B1IDA0.8
BEQN-(CARBOXYMETHYL)-N,N-DIMETHYL-
3-[(1-OXODODECYL)AMINO]-1-PROPANAMINIUM INNER SALT
A,B,C,D1YBK0.72
RIN3-AMINO-AZACYCLOTRIDECAN-2-ONEA,B1KBC0.84
BUJ(3R)-3-(hexadecanoylamino)-4-(trimethylammonio)butanoateA,B2RCU0.73
RHS3-(CARBOXYAMIDE(2-CARBOXYAMIDE-
2-TERTBUTYLETHYL))PENTAN
A1JLD0.78