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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00030157

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AXFA,B,C2F3F0.71
AXQ{(E)-(3R,6S,9R)-3-[(1S,3R)-3-((S)-
1 -BUTYLCARBAMOYL-2-METHYL-PROPYLCARB AMOYL)-
1-HYDROXY-BUTYL]-6-METHYL-5, 8-
DIOXO-1,11-DITHIA-4,7-DIAZA-CYCLO PENTADEC-
13-EN-9-YL}-CARBAMIC ACID TERT-
BUTYL ESTER
A,B,C2F3E0.71
2NHN-ACETYL-S-[(2E,6E)-3,7,11-TRIMETHYLDODECA-
2,6,10-TRIENYL]-L-CYSTEINYL-D-VALYL-
L-ISOLEUCYL-L-METHIONINE
B1O1T0.71
G395-N-ACETYL-3-(1-ETHYLPROPYL)-1-
CYCLOHEXENE-1-CARBOXYLIC ACID
A2QWH0.71
G395-N-ACETYL-3-(1-ETHYLPROPYL)-1-
CYCLOHEXENE-1-CARBOXYLIC ACID
A3CL00.71
G395-N-ACETYL-3-(1-ETHYLPROPYL)-1-
CYCLOHEXENE-1-CARBOXYLIC ACID
A2QWK0.71
G395-N-ACETYL-3-(1-ETHYLPROPYL)-1-
CYCLOHEXENE-1-CARBOXYLIC ACID
A,B,C,D,E,F,
G,H
3CL20.71
G395-N-ACETYL-3-(1-ETHYLPROPYL)-1-
CYCLOHEXENE-1-CARBOXYLIC ACID
A2HT80.71
G395-N-ACETYL-3-(1-ETHYLPROPYL)-1-
CYCLOHEXENE-1-CARBOXYLIC ACID
A2HT70.71
G395-N-ACETYL-3-(1-ETHYLPROPYL)-1-
CYCLOHEXENE-1-CARBOXYLIC ACID
B2HU00.71
G395-N-ACETYL-3-(1-ETHYLPROPYL)-1-
CYCLOHEXENE-1-CARBOXYLIC ACID
A,B,C,D,E,F,
G,H
2HU40.71
GDT(2E,4E)-N-[(2S,3R)-3-hydroxy-1-
[[(3Z,5S,8S,10S)-10-hydroxy-5-methyl-
2,7-dioxo-1,6-diazacyclododec-3-
en-8-yl]amino]-1-oxobutan-2-yl]dodeca-
2,4-dienamide
H,K,V,Y3BDM0.7