Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03302416
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
MNB![]() | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1F42 | 0.72 | ![]() |
MNB![]() | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1RXE | 0.72 | ![]() |
MNB![]() | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 2PER | 0.72 | ![]() |
BHA![]() | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBC | 0.75 | ![]() |
BHA![]() | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBF | 0.75 | ![]() |
BHA![]() | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1SXK | 0.75 | ![]() |
MTB![]() | A,B | 1SRF | 0.78 | ![]() | |
MHB![]() | A,B | 1SRG | 0.8 | ![]() | |
NCR![]() | 2-NITRO-P-CRESOL | A,B | 1AHV | 0.76 | ![]() |
NTD![]() | 2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE- 1,3-DIONE | A,B | 1T47 | 0.77 | ![]() |
TY2![]() | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.72 | ![]() |
135![]() | N-(4-CARBAMIMIDOYL-PHENYL)-2-HYDROXY- BENZAMIDE | B | 1GJA | 0.73 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 2ADP | 0.77 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 3DIV | 0.77 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 2H5U | 0.77 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 1K4Q | 0.77 | ![]() |
NIY![]() | META-NITRO-TYROSINE | B,G,O,Y | 1SDA | 0.77 | ![]() |
NAB![]() | A,B | 1SRJ | 0.74 | ![]() | |
4NB![]() | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.76 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 1Z44 | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYW | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | H,L | 1YEK | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A,C,E,G | 43CA | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1LS6 | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZVP | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2I10 | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A | 1VAH | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 3ETT | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | A,B | 2D20 | 0.7 | ![]() |
NPO![]() | P-NITROPHENOL | X | 2ZYV | 0.7 | ![]() |
B23![]() | 5-(2-NITROPHENYL)-2-FUROIC ACID | A | 2Q92 | 0.71 | ![]() |
HAB![]() | A,B | 1SRE | 0.78 | ![]() | |
NPC![]() | 4-HYDROXY-3-NITROPHENYLACETYL-EPSILON- AMINOCAPROIC ACID ANION | H,I,J | 1A6V | 0.72 | ![]() |
AZY![]() | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.71 | ![]() |
AAN![]() | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.73 | ![]() |
MNP![]() | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.72 | ![]() |
1FL![]() | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 2BXE | 0.71 | ![]() |
1FL![]() | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 3D2T | 0.71 | ![]() |
BIA![]() | 1-(3,4,DIHYDROXY-5-NITROPHENYL)- 3-{4-[3-(TRIFLUOROMETHYL) PHENYL] PIPERAZIN- 1-YL}PROPAN-1-ONE | A | 1H1D | 0.72 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.72 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.72 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.72 | ![]() |
GAB![]() | 3-AMINOBENZOIC ACID | A | 3FHB | 0.72 | ![]() |
DBE![]() | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.72 | ![]() |
MNY![]() | 5,8-DI-AMINO-1,4-DIHYDROXY-ANTHRAQUINONE | A | 1M2R | 0.77 | ![]() |
HNA![]() | 1,8-DI-HYDROXY-4-NITRO-ANTHRAQUINONE | A | 1M2P | 0.86 | ![]() |
HCC![]() | 2',4,4'-TRIHYDROXYCHALCONE | D | 1FP1 | 0.72 | ![]() |
NPA![]() | 2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID | H | 1NGP | 0.8 | ![]() |
MNX![]() | 1,8-DI-HYDROXY-4-NITRO-XANTHEN- 9-ONE | A | 1M2Q | 0.79 | ![]() |
272![]() | 4-(6-HYDROXY-BENZO[D]ISOXAZOL-3- YL)BENZENE-1,3-DIOL | A,B,C,D | 1U3Q | 0.73 | ![]() |
DNT![]() | 2-[1-METHYLHEXYL]-4,6-DINITROPHENOL | A,B,C | 1NEN | 0.74 | ![]() |
DMB![]() | A,B | 1SRI | 0.8 | ![]() | |
C00![]() | 2-(4-hydroxybiphenyl-3-yl)-4-methyl- 1H-isoindole-1,3(2H)-dione | A | 3BYX | 0.73 | ![]() |
C00![]() | 2-(4-hydroxybiphenyl-3-yl)-4-methyl- 1H-isoindole-1,3(2H)-dione | A | 3BZ0 | 0.73 | ![]() |
SCL![]() | ACETIC ACID SALICYLOYL-AMINO-ESTER | A | 1EBV | 0.77 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | X | 1V0H | 0.76 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | A | 2QPK | 0.76 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | A | 3FNL | 0.76 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | A | 3GCJ | 0.76 | ![]() |
SHA![]() | SALICYLHYDROXAMIC ACID | A | 1CK6 | 0.76 | ![]() |
MR2![]() | 3-DIPHENOL-6-NITRO-3H-BENZO[DE]ISOCHROMEN- 1-ONE | A | 1TSM | 0.75 | ![]() |
BRS![]() | 2-[1-(4-CHLORO-PHENYL)-ETHYL]-4,6- DINITRO-PHENOL | A,B,D,M,N,O,P | 1KFY | 0.72 | ![]() |
BIE![]() | (3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE | A,B | 2CL5 | 0.79 | ![]() |
4A3![]() | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.71 | ![]() |
G50![]() | 3-(4-HYDROXYPHENYL)-1-(2,4,6-TRIHYDROXYPHENYL)PROPAN- 1-ONE | A,B | 2UXI | 0.72 | ![]() |