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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03767020

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J2FIV0.75
ALNNAPHTHALEN-2-YL-3-ALANINEA,B1B0H0.75
ALNNAPHTHALEN-2-YL-3-ALANINEB1FIV0.75
ALNNAPHTHALEN-2-YL-3-ALANINEA,B,I,J3FIV0.75
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.84
B2FPHENYLALANINE BORONIC ACIDA,P1GBM0.78
B2FPHENYLALANINE BORONIC ACIDA,P1GBD0.78
B2FPHENYLALANINE BORONIC ACIDA,P1P060.78
B2FPHENYLALANINE BORONIC ACIDA,P1GBI0.78
B2FPHENYLALANINE BORONIC ACIDA,P8LPR0.78
2631-(azidomethyl)-3-methylbenzeneX2RB20.74
745TRANS-6-(2-PHENYLCYCLOPROPYL)-NAPHTHALENE-
2-CARBOXAMIDINE
A1U6Q0.72
BASN-(1-PHENYL-PROPYL)-FORMAMIDEE,F,G,H1NJU0.72
BASN-(1-PHENYL-PROPYL)-FORMAMIDEY,Z1JQ70.72
BASN-(1-PHENYL-PROPYL)-FORMAMIDEC1NKM0.72
AN3ANTHRACENEA,B2HMN0.76
AN3ANTHRACENEA,B2HMM0.76
0071-METHYLAMINE-1-BENZYL-CYCLOPENTANEA,B,C,D2BUA0.8
BHYN,N'-[biphenyl-4,4'-diyldi(2R)propane-
2,1-diyl]dimethanesulfonamide
A,B3BBR0.76
34A3,4-DIMETHYLANILINEA1L4K0.7
9AP9-AMINOPHENANTHRENEA1EGY0.75
ABNBENZYLAMINED,H2HXC0.75
ABNBENZYLAMINEA,I1A860.75
ABNBENZYLAMINEA1UTN0.75
ABNBENZYLAMINEA1N6X0.75
ABNBENZYLAMINEA2BZA0.75
ABNBENZYLAMINEA2EUS0.75
ABNBENZYLAMINEA1N6Y0.75
ABNBENZYLAMINEA1UTJ0.75
ANCANTHRACEN-1-YLAMINEA,B1GT10.76
ANCANTHRACEN-1-YLAMINEA,B1HN20.76
271N-methyl-1-phenylmethanamineX2RBT0.73
4FP4-(4-FLUOROBENZYL)PIPERIDINEA2OHN0.74
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.7
1PC1-(PHENYL-1-CYCLOHEXYL)PIPERIDINEB,C2PCP0.71
2671-(azidomethyl)-3-methylbenzeneA2RBQ0.74