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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00035433

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
HU1TERT-BUTYL {(1S)-2-[(1R,2S,5S)-
2-({[(1S)-3-AMINO-1-(CYCLOBUTYLMETHYL)-
2,3-DIOXOPROPYL]AMINO}CARBONYL)-
6,6-DIMETHYL-3-AZABICYCLO[3.1.0]HEX-
3-YL]-1-CYCLOHEXYL-2-OXOETHYL}CARBAMATE
A,C2OC00.7
NMP2-[2-(2-CYCLOHEXYL-2-GUANIDINO-
ACETYLAMINO)-ACETYLAMINO]-N-(3-
MERCAPTO-PROPYL)-PROPIONAMIDE
A1M4B0.73
BE8A,C3EYD0.73
Y11N-[(1S)-2-[(4-cyano-1-methylpiperidin-
4-yl)amino]-1-(cyclohexylmethyl)-
2-oxoethyl]morpholine-4-carboxamide
A,B2R9M0.7
IGN{[(1R)-2-((2S)-2-{[(3-{[AMINO(IMINO)METHYL]AMINO}PROPYL)AMINO]CARBONYL}PIPERIDINYL)-
1-(CYCLOHEXYLMETHYL)-2-OXOETHYL]AMINO}ACETIC ACID
A1K1O0.71
IGN{[(1R)-2-((2S)-2-{[(3-{[AMINO(IMINO)METHYL]AMINO}PROPYL)AMINO]CARBONYL}PIPERIDINYL)-
1-(CYCLOHEXYLMETHYL)-2-OXOETHYL]AMINO}ACETIC ACID
H,I1K210.71
TRL{1-[2-(1-FORMYL-PROPYL)-3-METHANESULFONYLAMINO-
PYRROLIDINE-1-CARBONYL]-2-METHYL-
PROPYL}-CARBAMIC ACID TERT-BUTYL ESTER
A,B1N1L0.72