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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00591466

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TY23-AMINO-L-TYROSINEA,B2VH30.7
012(4S)-N-[(1S,2R)-1-benzyl-3-{[3-
(dimethylamino)benzyl]amino}-2-
hydroxypropyl]-1-(3-methoxybenzyl)-
2-oxoimidazolidine-4-carboxamide
A,B,C3CKP0.71
ANTANTHRAMYCINA274D0.73
AYG[(4E)-2-[(1S)-1-AMINOETHYL]-4-(4-
HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-
1H-IMIDAZOL-1-YL]ACETIC ACID
A,B2OTB0.7
AYG[(4E)-2-[(1S)-1-AMINOETHYL]-4-(4-
HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-
1H-IMIDAZOL-1-YL]ACETIC ACID
A,B2OTE0.7
AYG[(4E)-2-[(1S)-1-AMINOETHYL]-4-(4-
HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-
1H-IMIDAZOL-1-YL]ACETIC ACID
A2HQK0.7
T1D5-(4-METHOXYBIPHENYL-3-YL)-1,2,5-
THIADIAZOLIDIN-3-ONE 1,1-DIOXIDE
A2BGD0.74
3GV(3S)-1-(2-hydroxyphenyl)-5-oxopyrrolidine-
3-carboxylic acid
A,B3GVB0.71
NPC4-HYDROXY-3-NITROPHENYLACETYL-EPSILON-
AMINOCAPROIC ACID ANION
H,I,J1A6V0.7
2AC2-AMINO-P-CRESOLH,I1A2C0.71
2AC2-AMINO-P-CRESOLA1L4M0.71
UA1N-(TERT-BUTOXYCARBONYL)-L-TYROSYL-
N-METHYL-4-(SULFOAMINO)-L-PHENYLALANINAMIDE
A2I4H0.72
UA1N-(TERT-BUTOXYCARBONYL)-L-TYROSYL-
N-METHYL-4-(SULFOAMINO)-L-PHENYLALANINAMIDE
A2I4G0.72
PIA{2-(1-AMINOETHYL)-4-[(4-HYDROXYPHENYL)METHYL]-
5-OXO-2,5-DIHYDRO-1H-IMIDAZOL-1-
YL}ACETALDEHYDE
A,B,C1H6R0.7
PIA{2-(1-AMINOETHYL)-4-[(4-HYDROXYPHENYL)METHYL]-
5-OXO-2,5-DIHYDRO-1H-IMIDAZOL-1-
YL}ACETALDEHYDE
A2JAD0.7
XYG[(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4-
HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-
1H-IMIDAZOL-1-YL]ACETIC ACID
A,B2PXW0.7
XYG[(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4-
HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-
1H-IMIDAZOL-1-YL]ACETIC ACID
A,B,C,D2FL10.7
XYG[(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4-
HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-
1H-IMIDAZOL-1-YL]ACETIC ACID
A,B2PXS0.7
XYG[(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4-
HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-
1H-IMIDAZOL-1-YL]ACETIC ACID
A,B,C,D2ICR0.7
4BGN-[4-(benzyloxy)phenyl]glycinamideA3CHO0.71
CR7[(4Z)-2-[(1S)-1,5-DIAMINOPENTYL]-
4-(4-HYDROXYBENZYLIDENE)-5-OXO-
4,5-DIHYDRO-1H-IMIDAZOL-1-YL]ACETIC ACID
A2A470.71
CR7[(4Z)-2-[(1S)-1,5-DIAMINOPENTYL]-
4-(4-HYDROXYBENZYLIDENE)-5-OXO-
4,5-DIHYDRO-1H-IMIDAZOL-1-YL]ACETIC ACID
A2A480.71
CR7[(4Z)-2-[(1S)-1,5-DIAMINOPENTYL]-
4-(4-HYDROXYBENZYLIDENE)-5-OXO-
4,5-DIHYDRO-1H-IMIDAZOL-1-YL]ACETIC ACID
A2A460.71
TCC2-(2,4-DICHLORO-PHENYLAMINO)-PHENOLA,B1NHW0.71
GN8(Z)-3-BENZYL-5-(2-HYDROXY-3-NITROBENZYLIDENE)-
2-THIOXOTHIAZOLIDIN-4-ONE
A,B,C,D,E,F2P6F0.72
FENN-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDEA1FEL0.75
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)B,C,D1TYM0.72
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)B,C,D1TYL0.72
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)A2OCU0.72
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)A,B,C,D,F3DJI0.72
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)A2DPZ0.72
LI63,4-DIHYDROXY-1-METHYLQUINOLIN-
2(1H)-ONE
A1YXV0.71
6792-CHLORO-5-[4-(3-CHLORO-PHENYL)-
2,5-DIOXO-2,5-DIHYDRO-1H-PYRROL-
3-YLAMINO]-BENZOIC ACID
A,B1Q4L0.71
L051-BENZYL-3-(4-METHOXYPHENYLAMINO)-
4-PHENYLPYRROLE-2,5-DIONE
A,B,C,D,E,F,
G,H
2ACL0.77
C002-(4-hydroxybiphenyl-3-yl)-4-methyl-
1H-isoindole-1,3(2H)-dione
A3BYX0.73
C002-(4-hydroxybiphenyl-3-yl)-4-methyl-
1H-isoindole-1,3(2H)-dione
A3BZ00.73