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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01816635

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
D182,5-BIS{[4-(N-ISOPROPYL)DIAMINOMETHYL]PHENYL}FURANB298D0.72
AL8(R)-3,4-DIHYDRO-2-(3-METHOXYPHENYL)-
4-METHYLAMINO-2H-THIENO[3,2-E]-
1,2-THIAZINE-6-SULFONAMIDE-1,1-
DIOXIDE
A1BNM0.7
BZT3-(3-BROMO-4-PYRROLIDIN-1-YLMETHYL-
BENZYL)-2-[4-PYRROLIDIN-1-YL-ETHOXY)-
PHENYL]-BENZO[B]THIOPHEN-6-OL
B,H1D3D0.72
DCH3-(7-DIAMINOMETHYL-NAPHTHALEN-2-
YL)-PROPIONIC ACID ETHYL ESTER
H1UVU0.7
AL9N-[(4-METHOXYPHENYL)METHYL]2,5-
THIOPHENEDESULFONAMIDE
A1BN40.75
462N-[amino(imino)methyl]-2-[2-(2-
chlorophenyl)-4-(4-propoxyphenyl)-
3-thienyl]acetamide
A2QU30.72
332(3R)-3-[(1,2,3,4-tetrahydroisoquinolin-
7-yloxy)methyl]-2,3-dihydrothieno[2,3-
f][1,4]oxazepin-5-amine
A,B3EBF0.78
AIU(2S,3R)-2-(4-{2-[(3S,4S)-3,4-DIMETHYLPYRROLIDIN-
1-YL]ETHOXY}PHENYL)-3-(4-HYDROXYPHENYL)-
2,3-DIHYDRO-1,4-BENZOXATHIIN-6-
OL
A1XP60.72
AIH(2S,3R)-2-(4-{2-[(3R,4R)-3,4-DIMETHYLPYRROLIDIN-
1-YL]ETHOXY}PHENYL)-3-(4-HYDROXYPHENYL)-
2,3-DIHYDRO-1,4-BENZOXATHIIN-6-
OL
A1XP10.72
BT23-[4-(2-PYRROLIDIN-1-YL-ETHOXY)-
BENZYL]-2-4-(2-PYRROLIDIN-1-YL-
ETHOXY)-PHENYL] -BENZO[B]THIOPHENE
B,H1D3Q0.75
AIJ(2S,3R)-3-(4-HYDROXYPHENYL)-2-(4-
{[(2S)-2-PYRROLIDIN-1-YLPROPYL]OXY}PHENYL)-
2,3-DIHYDRO-1,4-BENZOXATHIIN-6-
OL
A1XP90.72
189N-BENZYL-2-(2,6-DIMETHYLPHENOXY)-
N-[((3R,4S)-4-{[ISOBUTYL(PHENYLSULFONYL)AMINO]METHYL}PYRROLIDIN-
3-YL)METHYL]ACETAMIDE
A,B1XL20.73
11M1-(1'-{[3-(methylsulfanyl)-2-benzothiophen-
1-yl]carbonyl}spiro[1-benzofuran-
3,4'-piperidin]-5-yl)methanamine
A,B,C,D2ZEB0.75
DPDA,B1QIW0.78
DPDA1QIV0.78
006(4R)-3-[(2S,3S)-3-{[(2,6-dimethylphenoxy)acetyl]amino}-
2-hydroxy-4-phenylbutanoyl]-N-[(1S,2R)-
2-hydroxy-2,3-dihydro-1H-inden-
1-yl]-5,5-dimethyl-1,3-thiazolidine-
4-carboxamide
A,B,C,D3FNU0.7
190N-{(1S)-1-(3-BROMOBENZYL)-4-[(4-
BROMOPHENYL)SULFONYL]-6-METHYL-
2-OXOHEPTYL}-2-(2,6-DIMETHYLPHENOXY)ACETAMIDE
A,B1XL50.71
K214-[3-{1-(4-BENZYL)PIPERODINYL}PROPIONYL]-
7-METHOXY-2,3,4,5-TERTRAHYDRO-1,4-
BENZOTHIAZEPINE
A,B1HAK0.72
AL7(S)-3,4-DIHYDRO-2-(3-METHOXYPHENYL)-
4-METHYLAMINO-2H-THIENO[3,2-E]-
1,2-THIAZINE-6-SULFONAMIDE-1,1-
DIOXIDE
A1BNV0.7
11N1-[1'-(3-phenylacryloyl)spiro[1-
benzofuran-3,4'-piperidin]-5-yl]methanamine
A,B,C,D2ZEC0.71
AIT(2S,3R)-3-(4-HYDROXYPHENYL)-2-(4-
{[(2R)-2-PYRROLIDIN-1-YLPROPYL]OXY}PHENYL)-
2,3-DIHYDRO-1,4-BENZOXATHIIN-6-
OL
A1XPC0.72