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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01659450

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PNV(2S,5R,6R)-3,3-DIMETHYL-7-OXO-6-
(2-PHENOXYACETAMIDO)-4-THIA-1- AZABICYCLO(3.2.0)HEPTANE-
2-CARBOXYLIC ACID
A,C2Z710.85
PNV(2S,5R,6R)-3,3-DIMETHYL-7-OXO-6-
(2-PHENOXYACETAMIDO)-4-THIA-1- AZABICYCLO(3.2.0)HEPTANE-
2-CARBOXYLIC ACID
A2EX90.85
AGGTIROFIBANA,B2VDM0.72
NOQ(1R,2R)-N-(2-AMINOETHYL)-2-{[(4-
METHOXYPHENYL)SULFONYL]METHYL}CYCLOHEXANECARBOXAMIDE
A2F7D0.71
MM3N-HYDROXY-4-[(4-METHOXYLPHENYL)SULFONYL]-
2,2-DIMETHYL-HEXAHYDRO-1,4-THIAZEPINE-
3(S)-CARBOXAMIDE
A,B1D5J0.71
DRS(9S,12S)-9-(1-methylethyl)-7,10-
dioxo-2-oxa-8,11-diazabicyclo[12.2.2]octadeca-
1(16),14,17-triene-12-carboxylic acid
A,B3BXS0.75
PL7(2E)-2-({(2S)-2-CARBOXY-2-[(PHENOXYACETYL)AMINO]ETHOXY}IMINO)PENTANEDIOIC ACIDA2JCH0.77
4NH4-({4-[(4-AMINOBUT-2-YNYL)OXY]PHENYL}SULFONYL)-
N-HYDROXY-2,2-DIMETHYLTHIOMORPHOLINE-
3-CARBOXAMIDE
A,B2A8H0.74
ABYN-(4-AMINOBUTANOYL)-S-(4-METHOXYBENZYL)-
L-CYSTEINYLGLYCINE
A,B1PL20.83
ABYN-(4-AMINOBUTANOYL)-S-(4-METHOXYBENZYL)-
L-CYSTEINYLGLYCINE
A,B1PL10.83
MTJN,O-DIMETHYL-L-TYROSINEA,B1ATL0.7
INZ2-{4-[(2S)-2-[({[(1S)-1-CARBOXY-
2-PHENYLETHYL]AMINO}CARBONYL)AMINO]-
3-OXO-3-(PENTYLAMINO)PROPYL]PHENOXY}MALONIC ACID
A1G7F0.71
IH6(3S)-4-{[4-(BUT-2-YNYLOXY)PHENYL]SULFONYL}-
N-HYDROXY-2,2-DIMETHYLTHIOMORPHOLINE-
3-CARBOXAMIDE
A,B1ZXC0.74
MP2N-[(BENZYLOXY)CARBONYL]-L-CYSTEINYLGLYCINEA,B2FU90.71
MO9(1R)-2-[(CYANOMETHYL)AMINO]-1-({[2-
(DIFLUOROMETHOXY)BENZYL]SULFONYL}METHYL)-
2-OXOETHYL MORPHOLINE-4-CARBOXYLATE
A,B2G7Y0.76
MC1METHICILLIN ACYL-SERINEA,B1MWU0.71
FLEFUROYL-LEUCINEA,B3DSL0.7
FLEFUROYL-LEUCINEA3AIG0.7
FLEFUROYL-LEUCINEI,P2AIG0.7
BHP(S)-5-(4-BENZYLOXY-PHENYL)-4-(7-
PHENYL-HEPTANOYLAMINO)-PENTANOIC ACID
A,B1J1A0.7
HA26-[{(2S)-2-AMINO-3-[4-(BENZYLOXY)PHENYL]PROPYL}(HYDROXY)AMINO]-
6-OXOHEXANOIC ACID)
A2VJ80.71
NXN2-(2,4-DICHLORO-PHENOXY)-N-(2-MERCAPTO-
ETHYL)-ACETAMIDE
A,B1SHJ0.74
NN4(1S,3R,4S,5S,7S)-4-{[2-(4-METHOXYPHENOXY)-
2-METHYLPROPANOYL]AMINO}ADAMANTANE-
1-CARBOXAMIDE
A,B,C,D,E,F,
G,H
2IRW0.73