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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01003380

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4BQ(2S)-2-amino-5-oxo-5-[(4-phenylmethoxyphenyl)amino]pentanoic acidA3CHQ0.72
RPF1-{4-[3-(2-METHOXY-BENZYLOXY)-PROPOXY]-
PHENYL}-6-(1,2,,3,4-TETRAHYDRO-
QUINOLIN-7-YLOXYMETHYL)-PIPERAZIN-
2-ONE
A,B2BKT0.7
AL13,,4-DIHYDRO-2-(3-METHOXYPHENYL)-
2H-THIENO-[3,2-E]-1,2-THIAZINE-
6-SULFONAMIDE-1,1-DIOXIDE
A1BNN0.76
MUT(5S)-3-(3-ACETYLPHENYL)-N-[(1S,2R)-
1-BENZYL-2-HYDROXY-3-{ISOBUTYL[(4-
METHOXYPHENYL)SULFONYL]AMINO}PROPYL]-
2-OXO-1,3-OXAZOLIDINE-5-CARBOXAMIDE
A,B2I0D0.74
IC13-[(2,4,6-TRIMETHOXY-PHENYL)-METHYLENE]-
INDOLIN-2-ONE
A,B1EH40.75
ZY3N-{(1S,2R)-1-BENZYL-2-HYDROXY-3-
[(3-METHOXYBENZYL)AMINO]PROPYL}-
6-(ETHYLAMINO)-1-METHYL-1,3,4,5-
TETRAHYDRO-2,1-BENZOTHIAZEPINE-
8-CARBOXAMIDE 2,2-DIOXIDE
A2WF30.72
LS1N-METHYL-4-{[(2-OXO-1,2-DIHYDRO-
3H-INDOL-3-YLIDENE)METHYL]AMINO}BENZENESULFONAMIDE
A1KE50.71
C7M(2S,3R)-N-[5-CHLORO-2-(2,3-DIHYDRO-
1H-TETRAZOL-1-YL)BENZYL]-3-HYDROXY-
4-{[(4-METHOXYPHENYL)SULFONYL]AMINO}-
1-PHENYLBUTAN-2-AMINIUM
B,I2C8W0.7
HBBN-{(2R)-2-HYDROXY-2-[(8S,11S)-8-
ISOPROPYL-6,9-DIOXO-2-OXA-7,10-
DIAZABICYCLO[11.2.2]HEPTADECA-1(15),13,16-
TRIEN-11-YL]ETHYL}-N-ISOPENTYLBENZENESULFONAMIDE
A,B1Z1H0.71
T1D5-(4-METHOXYBIPHENYL-3-YL)-1,2,5-
THIADIAZOLIDIN-3-ONE 1,1-DIOXIDE
A2BGD0.78
INL6-[N-(3-METHOXY-PHENYL)-3-(MORPHOLIN-
4-YLMETHYL)-2H-THIENO[3,2-E]-1,2-
THIAZINE-1,1,-DIOXIDE]-SULFONAMIDE
A1I8Z0.71
L051-BENZYL-3-(4-METHOXYPHENYLAMINO)-
4-PHENYLPYRROLE-2,5-DIONE
A,B,C,D,E,F,
G,H
2ACL0.76
AL62-(3-METHOXYPHENYL)-2H-THIENO-[3,2-
E]-1,2-THIAZINE-6-SULFINAMIDE-1,1-
DIOXIDE
A1BN30.72
4BS4-amino-N-[4-(benzyloxy)phenyl]butanamideA3CHR0.77
AL7(S)-3,4-DIHYDRO-2-(3-METHOXYPHENYL)-
4-METHYLAMINO-2H-THIENO[3,2-E]-
1,2-THIAZINE-6-SULFONAMIDE-1,1-
DIOXIDE
A1BNV0.76
GNQN-[(1R)-1-[(BENZYLSULFONYL)METHYL]-
2-{[(1S)-1-METHYL-2-{[4-(TRIFLUOROMETHOXY)PHENYL]AMINO}ETHYL]AMINO}-
2-OXOETHYL]MORPHOLINE-4-CARBOXAMIDE
A,B2HHN0.76
GNQN-[(1R)-1-[(BENZYLSULFONYL)METHYL]-
2-{[(1S)-1-METHYL-2-{[4-(TRIFLUOROMETHOXY)PHENYL]AMINO}ETHYL]AMINO}-
2-OXOETHYL]MORPHOLINE-4-CARBOXAMIDE
A,B2HH50.76
AL23,4-DIHYDRO-4-HYDROXY-2-(4-METHOXYPHENYL)-
2H-THIENO[3,2-E]-1,2-THIAZINE-6-
SULFONAMIDE-1,1-DIOXIDE
A1BNT0.76
4BO(3S)-3-amino-4-oxo-4-[(4-phenylmethoxyphenyl)amino]butanoic acidA3CHP0.72
4BGN-[4-(benzyloxy)phenyl]glycinamideA3CHO0.76
AL8(R)-3,4-DIHYDRO-2-(3-METHOXYPHENYL)-
4-METHYLAMINO-2H-THIENO[3,2-E]-
1,2-THIAZINE-6-SULFONAMIDE-1,1-
DIOXIDE
A1BNM0.76
BSDN-{(1S,2R)-1-benzyl-2-hydroxy-3-
[(3-methoxybenzyl)amino]propyl}-
5-[methyl(methylsulfonyl)amino]-
N'-[(1R)-1-phenylethyl]benzene-
1,3-dicarboxamide
A,B,C,D2VKM0.7
BBH1-BENZYL-3-(4-METHOXY-BENZENESULFONYL)-
6-OXO-HEXAHYDRO-PYRIMIDINE-4-CARBOXYLIC ACID HYDROXYAMIDE
A,B1D8M0.73
BBH1-BENZYL-3-(4-METHOXY-BENZENESULFONYL)-
6-OXO-HEXAHYDRO-PYRIMIDINE-4-CARBOXYLIC ACID HYDROXYAMIDE
A,B1G050.73
PI9A,B1D4L0.76
N4EN-(4-ethoxyphenyl)acetamideA,B,C,D3EBS0.7
RYU(2E,3S)-3-HYDROXY-5'-[(4-HYDROXYPIPERIDIN-
1-YL)SULFONYL]-3-METHYL-1,3-DIHYDRO-
2,3'-BIINDOL-2'(1'H)-ONE
A2BHH0.72
TF2(N-{4-[(ETHYLANILINO)SULFONYL]-
2-METHYLPHENYL}-3,3,3-TRIFLUORO-
2-HYDROXY-2-METHYLPROPANAMIDE
A2BU60.7
GVB(3R,4S)-1-(3,4-DIMETHOXYPHENYL)-
3-(3-METHYLPHENYL)PIPERIDIN-4-AMINE
A,B2JID0.72
012(4S)-N-[(1S,2R)-1-benzyl-3-{[3-
(dimethylamino)benzyl]amino}-2-
hydroxypropyl]-1-(3-methoxybenzyl)-
2-oxoimidazolidine-4-carboxamide
A,B,C3CKP0.73
MUI(5S)-3-(4-ACETYLPHENYL)-N-[(1S,2R)-
1-BENZYL-2-HYDROXY-3-{ISOBUTYL[(4-
METHOXYPHENYL)SULFONYL]AMINO}PROPYL]-
2-OXO-1,3-OXAZOLIDINE-5-CARBOXAMIDE
A,B2I0A0.74
2PD5-hydroxy-4-(7-methoxy-1,1-dioxido-
2H-1,2,4-benzothiadiazin-3-yl)-
2-(3-methylbutyl)-6-phenylpyridazin-
3(2H)-one
A,B3BSC0.71
189N-BENZYL-2-(2,6-DIMETHYLPHENOXY)-
N-[((3R,4S)-4-{[ISOBUTYL(PHENYLSULFONYL)AMINO]METHYL}PYRROLIDIN-
3-YL)METHYL]ACETAMIDE
A,B1XL20.73
MSI1-METHYL-5-(2-PHENOXYMETHYL-PYRROLIDINE-
1-SULFONYL)-1H-INDOLE-2,3-DIONE
A1GFW0.81
MZ9N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-
{[(4-METHOXYPHENYL)SULFONYL][(2S)-
2-METHYLBUTYL]AMINO}PROPYL]-4-OXOHEXANAMIDE
A,B2QI70.72
MUUN-[(1S,2R)-1-BENZYL-3-{(CYCLOPROPYLMETHYL)[(3-
METHOXYPHENYL)SULFONYL]AMINO}-2-
HYDROXYPROPYL]-N'-METHYLSUCCINAMIDE
A,B2PSU0.72
SPIN-HYDROXY-1-(4-METHOXYPHENYL)SULFONYL-
4-BENZYLOXYCARBONYL-PIPERAZINE-
2-CARBOXAMIDE
A,B1D8F0.71
GSG1S,3AS,8AS-TRIMETHYL-1-OXIDO-1,2,3,3A,8,8A-
HEXAHYDROPYRROLO[2,3-B]INDOL-5-
YL 2-ETHYLPHENYLCARBAMATE
A2BAG0.73
CP8A1UTT0.75
4BU(2S)-2-amino-5-[[4-[(2S)-2-hydroxy-
2-phenyl-ethoxy]phenyl]amino]-5-
oxo-pentanoic acid
A3CHS0.7