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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02903404

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
53UD-phenylalanyl-N-benzyl-L-prolinamideH,I2ZFF0.7
0071-METHYLAMINE-1-BENZYL-CYCLOPENTANEA,B,C,D2BUA0.79
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA1QWC0.84
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1FOI0.84
14WN-(3-(AMINOMETHYL)BENZYL)ACETAMIDINEA,B1QW50.84
2BFALPHA-BENZYL-AMINOBENZYL-PHOSPHONIC ACIDA,B,C,D1ND50.84
AU44,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)A2PYZ0.72
1MRN-METHYLANILINEX2OTZ0.72
ABNBENZYLAMINED,H2HXC0.88
ABNBENZYLAMINEA,I1A860.88
ABNBENZYLAMINEA1UTN0.88
ABNBENZYLAMINEA1N6X0.88
ABNBENZYLAMINEA2BZA0.88
ABNBENZYLAMINEA2EUS0.88
ABNBENZYLAMINEA1N6Y0.88
ABNBENZYLAMINEA1UTJ0.88
2671-(azidomethyl)-3-methylbenzeneA2RBQ0.8
4FP4-(4-FLUOROBENZYL)PIPERIDINEA2OHN0.83
1PC1-(PHENYL-1-CYCLOHEXYL)PIPERIDINEB,C2PCP0.8
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3B2Q0.72
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4T0.72
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEO,P,Q,R2B4R0.72
AES4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDEA,B3EIU0.72
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2OUA0.7
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B,C,D2AJC0.7
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B3PRO0.7
2AB4-(2-AMINOETHYL)BENZENESULFONIC ACIDA,B2PFE0.7
2631-(azidomethyl)-3-methylbenzeneX2RB20.8
264(phenylamino)acetonitrileA2RBN0.73
BACN-(4-IODO-BENZYL)-FORMAMIDEA,B,C,D2WPO0.85
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.81
B2FPHENYLALANINE BORONIC ACIDA,P1GBM0.82
B2FPHENYLALANINE BORONIC ACIDA,P1GBD0.82
B2FPHENYLALANINE BORONIC ACIDA,P1P060.82
B2FPHENYLALANINE BORONIC ACIDA,P1GBI0.82
B2FPHENYLALANINE BORONIC ACIDA,P8LPR0.82
APE(1-AMINO-2-PHENYL-ETHYL)-CARBAMIC ACIDE,I1SCN0.75
34A3,4-DIMETHYLANILINEA1L4K0.71
271N-methyl-1-phenylmethanamineX2RBT0.95