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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03762545

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
APF1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN-
2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)
B,C1GG60.71
APF1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN-
2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)
G6GCH0.71
BACN-(4-IODO-BENZYL)-FORMAMIDEA,B,C,D2WPO0.8
53UD-phenylalanyl-N-benzyl-L-prolinamideH,I2ZFF0.7
2671-(azidomethyl)-3-methylbenzeneA2RBQ0.79
ABNBENZYLAMINED,H2HXC0.82
ABNBENZYLAMINEA,I1A860.82
ABNBENZYLAMINEA1UTN0.82
ABNBENZYLAMINEA1N6X0.82
ABNBENZYLAMINEA2BZA0.82
ABNBENZYLAMINEA2EUS0.82
ABNBENZYLAMINEA1N6Y0.82
ABNBENZYLAMINEA1UTJ0.82
0071-METHYLAMINE-1-BENZYL-CYCLOPENTANEA,B,C,D2BUA0.79
34A3,4-DIMETHYLANILINEA1L4K0.73
4FP4-(4-FLUOROBENZYL)PIPERIDINEA2OHN0.8
AU44,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)A2PYZ0.78
2BFALPHA-BENZYL-AMINOBENZYL-PHOSPHONIC ACIDA,B,C,D1ND50.77
1PC1-(PHENYL-1-CYCLOHEXYL)PIPERIDINEB,C2PCP0.8
B2FPHENYLALANINE BORONIC ACIDA,P1GBM0.79
B2FPHENYLALANINE BORONIC ACIDA,P1GBD0.79
B2FPHENYLALANINE BORONIC ACIDA,P1P060.79
B2FPHENYLALANINE BORONIC ACIDA,P1GBI0.79
B2FPHENYLALANINE BORONIC ACIDA,P8LPR0.79
APE(1-AMINO-2-PHENYL-ETHYL)-CARBAMIC ACIDE,I1SCN0.73
271N-methyl-1-phenylmethanamineX2RBT0.91
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.81
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA1QWC0.81
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1FOI0.81
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1QW50.81
51UD-phenylalanyl-N-(3-methylbenzyl)-
L-prolinamide
H,I2ZF00.72
2631-(azidomethyl)-3-methylbenzeneX2RB20.79
BASN-(1-PHENYL-PROPYL)-FORMAMIDEE,F,G,H1NJU0.88
BASN-(1-PHENYL-PROPYL)-FORMAMIDEY,Z1JQ70.88
BASN-(1-PHENYL-PROPYL)-FORMAMIDEC1NKM0.88
1MRN-METHYLANILINEX2OTZ0.71