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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03024877

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CPUA,B1CR60.73
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA1QWC0.73
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1FOI0.73
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1QW50.73
0071-METHYLAMINE-1-BENZYL-CYCLOPENTANEA,B,C,D2BUA0.76
2631-(azidomethyl)-3-methylbenzeneX2RB20.73
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.74
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3B2Q0.71
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4T0.71
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4R0.71
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3EIU0.71
FBA4-FLUOROBENZYLAMINEB,D,E1AFQ0.75
FBA4-FLUOROBENZYLAMINEA1TNH0.75
BASN-(1-PHENYL-PROPYL)-FORMAMIDEE,F,G,H1NJU0.78
BASN-(1-PHENYL-PROPYL)-FORMAMIDEY,Z1JQ70.78
BASN-(1-PHENYL-PROPYL)-FORMAMIDEC1NKM0.78
271N-methyl-1-phenylmethanamineX2RBT0.84
BTMN-benzyl-N,N-diethylethanaminiumA,B2Q9Y0.76
B2FPHENYLALANINE BORONIC ACIDA,P1GBM0.81
B2FPHENYLALANINE BORONIC ACIDA,P1GBD0.81
B2FPHENYLALANINE BORONIC ACIDA,P1P060.81
B2FPHENYLALANINE BORONIC ACIDA,P1GBI0.81
B2FPHENYLALANINE BORONIC ACIDA,P8LPR0.81
4FP4-(4-FLUOROBENZYL)PIPERIDINEA2OHN0.78
BACN-(4-IODO-BENZYL)-FORMAMIDEA,B,C,D2WPO0.74
BZZBENZYLHYDRAZINEA,B2E2V0.71
DPKDEPRENYLA,B2BYB0.78
EOAN-PHENETHYL-FORMAMIDEH,I1A5G0.82
2671-(azidomethyl)-3-methylbenzeneA2RBQ0.73
BNFN-BENZYLFORMAMIDEA,B1U3U0.76
ABNBENZYLAMINED,H2HXC0.78
ABNBENZYLAMINEA,I1A860.78
ABNBENZYLAMINEA1UTN0.78
ABNBENZYLAMINEA1N6X0.78
ABNBENZYLAMINEA2BZA0.78
ABNBENZYLAMINEA2EUS0.78
ABNBENZYLAMINEA1N6Y0.78
ABNBENZYLAMINEA1UTJ0.78
APE(1-AMINO-2-PHENYL-ETHYL)-CARBAMIC ACIDE,I1SCN0.74