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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00007270

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GVB(3R,4S)-1-(3,4-DIMETHOXYPHENYL)-
3-(3-METHYLPHENYL)PIPERIDIN-4-AMINE
A,B2JID0.71
MR11-(1,3-BENZODIOXOL-5-YL)METHANAMINEA2ORQ0.74
4BS4-amino-N-[4-(benzyloxy)phenyl]butanamideA3CHR0.75
ZHH2-(4-METHOXYPHENYL)ETHANAMINED,H2HKR0.8
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEA,B,C,D,I,J,
K,L
3EWF0.77
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEA,B,I,L2V5W0.77
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEB1VDN0.77
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEC1VAI0.77
PZM1-(4-METHOXYPHENYL)METHANAMINEA,D,H2HJB0.82
3MB3-METHOXYBENZAMIDEA3PAX0.76
GP81-(2-AMIDINOPHENYL)-3-(PHENOXYPHENYL)UREAA1BJV0.71
T1D5-(4-METHOXYBIPHENYL-3-YL)-1,2,5-
THIADIAZOLIDIN-3-ONE 1,1-DIOXIDE
A2BGD0.7
ZHZ2-(4-METHOXYPHENYL)ACETAMIDED,H2HKR0.75
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)B,C,D1TYM0.7
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)B,C,D1TYL0.7
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)A2OCU0.7
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)A,B,C,D,F3DJI0.7
TYLN-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)A2DPZ0.7
SOAISATOIC ANHYDRIDEA1BIO0.74
MAZFORMIC ACID 3-AMINO-BENZYL ESTERH,L1JYQ0.78
505(2R)-1-(2,6-dimethylphenoxy)propan-
2-amine
A2VIN0.71
4BGN-[4-(benzyloxy)phenyl]glycinamideA3CHO0.76
2AF2-AMINOPHENOLA1L4N0.72
N4EN-(4-ethoxyphenyl)acetamideA,B,C,D3EBS0.78
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V970.7
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V980.7
CFQ1-(2-nitrophenyl)-2,2,2-trifluoroethyl]-
arsenocholine
A,B2V960.7
EPN3-(4-NITRO-PHENOXY)-PROPAN-1-OLA2SAM0.74
2AC2-AMINO-P-CRESOLH,I1A2C0.78
2AC2-AMINO-P-CRESOLA1L4M0.78
HV71-METHYLAMINE-2-HYDROXY-4-METHOXY-
BENZENE
C1A8G0.72
GAT4'-AMINOPHENYL-ALPHA-D-GALACTOPYRANOSIDED,E,F,G,H1EFI0.72
4NL4-AMINOPHENOLA2ORL0.76