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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02903514

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TY23-AMINO-L-TYROSINEA,B2VH30.78
4BQ(2S)-2-amino-5-oxo-5-[(4-phenylmethoxyphenyl)amino]pentanoic acidA3CHQ0.77
NIYMETA-NITRO-TYROSINEA2ADP0.84
NIYMETA-NITRO-TYROSINEA3DIV0.84
NIYMETA-NITRO-TYROSINEA2H5U0.84
NIYMETA-NITRO-TYROSINEA1K4Q0.84
NIYMETA-NITRO-TYROSINEB,G,O,Y1SDA0.84
DNT2-[1-METHYLHEXYL]-4,6-DINITROPHENOLA,B,C1NEN0.71
1954-{2,4-BIS[(3-NITROBENZOYL)AMINO]PHENOXY}PHTHALIC ACIDA1Z6Q0.75
T333,3'-DEIODO-THYROXINEA,B1THA0.76
DRF(2S)-2-ETHOXY-3-{4-[2-(10H-PHENOXAZIN-
10-YL)ETHOXY]PHENYL}PROPANOIC ACID
A1NYX0.71
4BGN-[4-(benzyloxy)phenyl]glycinamideA3CHO0.72
1944-{2-[(3-NITROBENZOYL)AMINO]PHENOXY}PHTHALIC ACIDA1Z6P0.74
HA26-[{(2S)-2-AMINO-3-[4-(BENZYLOXY)PHENYL]PROPYL}(HYDROXY)AMINO]-
6-OXOHEXANOIC ACID)
A2VJ80.74
T443,5,3',5'-TETRAIODO-L-THYRONINEX1Y0X0.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK10.75
T443,5,3',5'-TETRAIODO-L-THYRONINEC,D1ICT0.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA2RIW0.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B2ROX0.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B1IE40.75
T443,5,3',5'-TETRAIODO-L-THYRONINE1,21ETB0.75
T443,5,3',5'-TETRAIODO-L-THYRONINE1,21ETA0.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B,C1SN00.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B2CEO0.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B1F860.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK40.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK20.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK50.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK30.75
RQ32-{4-[(3,5-DIMETHYLANILINO)-CARBONYL-
METHYL]-PHENOXY}-2-METHYLPROPIONIC ACID
A,B,C,D1G9V0.71
CNO2-{4-[(3{2-[4-(1-CARBOXY-1-METHYL-
ETHOXY)-PHENYL]-ACETYLAMINO}-PHENYLCARBAMOYL)-
METHYL]-PHENOXY}-2-METHYL-PROPIONIC ACID
A,B,C,D1K0Y0.73
NFG2,4-DINITROPHENYL 2-DEOXY-2-FLUORO-
BETA-D-GLUCOPYRANOSIDE
A2PB10.71
NFG2,4-DINITROPHENYL 2-DEOXY-2-FLUORO-
BETA-D-GLUCOPYRANOSIDE
A1E4I0.71
NFG2,4-DINITROPHENYL 2-DEOXY-2-FLUORO-
BETA-D-GLUCOPYRANOSIDE
A1UYQ0.71
2TY2-HYDROXY-5-{[(1E)-2-PHENYLETHYLIDENE]AMINO}-
L-TYROSINE
A,B2CWV0.73
EPN3-(4-NITRO-PHENOXY)-PROPAN-1-OLA2SAM0.71
NPA2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACIDH1NGP0.75
TYQ3-AMINO-6-HYDROXY-TYROSINEA,B1D6Y0.75
TYQ3-AMINO-6-HYDROXY-TYROSINEA,B1D6U0.75
4BS4-amino-N-[4-(benzyloxy)phenyl]butanamideA3CHR0.72
NIP4-HYDROXY-5-IODO-3-NITROPHENYLACETYL-
EPSILON-AMINOCAPROIC ACID ANION
H1A6W0.74
P283',5'-DINITRO-N-ACETYL-L-THYRONINEA,B2ROY0.84
HV8BENZYL-2-AMINO-PARAMETHOXY-BENZYLSTATINEC1A8G0.72
MTJN,O-DIMETHYL-L-TYROSINEA,B1ATL0.72
296(3R)-3-amino-2,2-difluoro-3-(4-
methoxyphenyl)propanoic acid
A,B2RJS0.71
NBQ2-HYDROXY-5-({1-[(2-NAPHTHYLOXY)METHYL]-
3-OXOPROP-1-ENYL}AMINO)TYROSINE
A1SII0.72
TYNAMINOBENZOFURAZAN-O-TYROSINEA,B,C,D,E,F1NBM0.87
FLTFLUOROMALONYL TYROSINEI1BZH0.72
BHP(S)-5-(4-BENZYLOXY-PHENYL)-4-(7-
PHENYL-HEPTANOYLAMINO)-PENTANOIC ACID
A,B1J1A0.7
4BU(2S)-2-amino-5-[[4-[(2S)-2-hydroxy-
2-phenyl-ethoxy]phenyl]amino]-5-
oxo-pentanoic acid
A3CHS0.75
PNJPNP-BETA-D-GLUCOSAMINEA,B2VZU0.71
PNJPNP-BETA-D-GLUCOSAMINEA,B2VZT0.71
BIQBENZYL [12-(2-AMINO-2-OXOETHYL)-
4-NITRO-10,13-DIOXO-15-[(PROPYLAMINO)CARBONYL]-
2-OXA-11,14-DIAZATRICYCLO[15 .2.2.1~3,7~]DOCOSA-
1(19),3(22),4,6,17,20-HEXAEN-9-
YL]CARBAMATE
H,V2GPL0.77
AZY3-AZIDO-L-TYROSINEA2YXN0.77
MBQ2-HYDROXY-5-({1-[(4-METHYLPHENOXY)METHYL]-
3-OXOPROP-1-ENYL}AMINO)-L-TYROSINE
A1SIH0.76
NPC4-HYDROXY-3-NITROPHENYLACETYL-EPSILON-
AMINOCAPROIC ACID ANION
H,I,J1A6V0.76
B235-(2-NITROPHENYL)-2-FUROIC ACIDA2Q920.7
M2F2,4-DINITROPHENYL 2-DEOXY-2-FLUORO-
BETA-D-MANNOPYRANOSIDE
A,B2WBK0.71
4BO(3S)-3-amino-4-oxo-4-[(4-phenylmethoxyphenyl)amino]butanoic acidA3CHP0.75
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA1ZWP0.71
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA3E9X0.71
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA2OTH0.71
MNX1,8-DI-HYDROXY-4-NITRO-XANTHEN-
9-ONE
A1M2Q0.76
ACJ5-[2-CHLORO-4-(TRIFLUOROMETHYL)PHENOXY]-
2-NITROBENZOIC ACID
A,B2IVD0.71
PPNPARA-NITROPHENYLALANINEI1YTJ0.74
PRQ(3S)-3-amino-3-(2-nitrophenyl)propanoic acidC,F,I,L2VE60.71