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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02894690

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SP7N-{(1S)-3-[(4-aminobutyl)amino]-
1-methylpropyl}acetamide
A,B3CNP0.73
HAVHYDROXYAMINOVALINEA1BM60.73
HAVHYDROXYAMINOVALINEA1EUB0.73
A3M2-AMINO-3-METHYL-1-PYRROLIDIN-1-
YL-BUTAN-1-ONE
A,B1N1M0.82
RIN3-AMINO-AZACYCLOTRIDECAN-2-ONEA,B1KBC0.71
BUM2-AMINO-N,3,3-TRIMETHYLBUTANAMIDEA,B1GKC0.83
BUM2-AMINO-N,3,3-TRIMETHYLBUTANAMIDEA,B1GKD0.83
PPLPIPERIDINE-2-CARBOXYLIC ACID TERT-
BUTYLAMIDE
A,B1IDB0.73
PPLPIPERIDINE-2-CARBOXYLIC ACID TERT-
BUTYLAMIDE
A,B1IDA0.73
CLELEUCINE AMIDED1D5Z0.71
CLELEUCINE AMIDEC,D,E,F1QZ00.71
CLELEUCINE AMIDEC,D,E,F1XXV0.71
CLELEUCINE AMIDEA,D1D5M0.71
CLELEUCINE AMIDEC,D,E,F1XXP0.71
VLMVALINYLAMINEG,M,P,S1YYM0.78
VLMVALINYLAMINEG,M,P,S2I5Y0.78
VLMVALINYLAMINEG,M,P,S1YYL0.78
VLMVALINYLAMINEG,M,P,S2I600.78
BAA(TERT-BUTYLOXYCARBONYL)-ALANYL-
ALANYL-AMINE
A1ELG0.73
CIB2-ACETYLAMINO-4-METHYL-PENTANOIC ACID [1-
(1-FORMYL-PENTYLCARBAMOYL)-3-METHYL-
BUTYL]-AMIDE
H,I,J,K,L,M,N1J2Q0.75
RHS3-(CARBOXYAMIDE(2-CARBOXYAMIDE-
2-TERTBUTYLETHYL))PENTAN
A1JLD0.72
SSM(2S)-2-(acetylamino)-N-methyl-4-
[(S)-methylsulfinyl]butanamide
A3BQF0.72
LPDL-PROLINAMIDEH,S2H9E0.73
BUGTERT-LEUCYL AMINED1D6E0.72
AIO[(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN-
2-YL]BORONIC ACID
A2EEP0.79
AIO[(2R)-1-(L-ALANYL-L-ISOLEUCYL)PYRROLIDIN-
2-YL]BORONIC ACID
A2Z3Z0.79
MNVN-METHYL-C-AMINO VALINEC1CWJ0.91