Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03725592
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 |
HZH | 1,1,1-trifluoro-3-[(2-phenylethyl)sulfanyl]propan- 2-one | A,B | 3DEA | 0.79 |  |
5PV | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.72 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A | 1OS0 | 0.72 | |
| DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJI | 0.72 | |
| DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJJ | 0.72 | |
| DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2VS2 | 0.72 | |
| DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 1OD1 | 0.72 | |
| DPH | DEAMINO-METHYL-PHENYLALANINE | E | 1EPR | 0.72 | |
CVB | 4-(CARBOXYVIN-2-YL)PHENYLBORONIC ACID | A,B | 1KE0 | 0.7 | |
CPM | S-(2-CARBOXY-3-PHENYLPROPYL)THIODIIMINE- S-METHANE | A | 1CPS | 0.78 | |
BCS | BENZYLCYSTEINE | A,B,G,H | 10GS | 0.76 | |
| BCS | BENZYLCYSTEINE | A | 1EH8 | 0.76 | |
M5P | (S)-2-(MERCAPTOMETHYL)-5-PHENYLPENTANOIC ACID | A,B | 2YZ3 | 0.75 | |
ISA | 3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID | A | 1NX3 | 0.73 | |
| ISA | 3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID | A,B | 1ALW | 0.73 | |
CLT | 4-PHENYL-BUTANOIC ACID | A | 1THL | 0.7 | |
| CLT | 4-PHENYL-BUTANOIC ACID | A,B | 2AY7 | 0.7 | |
| CLT | 4-PHENYL-BUTANOIC ACID | E,I | 1TMN | 0.7 | |
R13 | 3-METHYL-7-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL) -OCTA-2,4,6-TRIENOIC ACID | A | 2CBS | 0.73 | |
OXE | ORTHO-XYLENE | A,B | 3E0X | 0.72 | |
| OXE | ORTHO-XYLENE | A | 188L | 0.72 | |
PTF | [(METHYLSULFANYL)METHYL]BENZENE | C,F | 1RHQ | 0.78 | |
PPT | 3-(P-TOLYL)PROPIONIC ACID | A,B | 2AY4 | 0.74 | |
ARL | 7-(3,5-DITERT-BUTYLPHENYL)-3-METHYLOCTA- 2,4,6-TRIENOIC ACID | A | 1NQ7 | 0.73 | |
RS7 | (2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID | A,B | 2P0M | 0.71 | |
| RS7 | (2E)-3-(2-OCT-1-YN-1-YLPHENYL)ACRYLIC ACID | A | 1LOX | 0.71 | |
HCI | HYDROCINNAMIC ACID | A,B | 1BXG | 0.71 | |
| HCI | HYDROCINNAMIC ACID | A,B | 1TOG | 0.71 | |
| HCI | HYDROCINNAMIC ACID | A,B | 1V2F | 0.71 | |
| HCI | HYDROCINNAMIC ACID | A,B | 1AHX | 0.71 | |
| HCI | HYDROCINNAMIC ACID | A | 1TOI | 0.71 | |
| HCI | HYDROCINNAMIC ACID | A,B | 1AY8 | 0.71 | |
| HCI | HYDROCINNAMIC ACID | A | 1TOJ | 0.71 | |
IBP | IBUPROFEN | A | 3FKX | 0.71 | |
| IBP | IBUPROFEN | A,B | 2BXG | 0.71 | |
| IBP | IBUPROFEN | A,B | 1EQG | 0.71 | |
| IBP | IBUPROFEN | A,B,C | 2WD9 | 0.71 | |
| IBP | IBUPROFEN | A | 2PWS | 0.71 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K5S | 0.71 | |
| GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1KEC | 0.71 | |
| GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K7D | 0.71 | |
BTP | 2-THIOMETHYL-3-PHENYLPROPANOIC ACID | A,B | 1JAO | 0.76 | |
SEH | S-BENZYL PHENYLACETOTHIOHYDROXIMATE- O-SULFATE | M | 1W9D | 0.71 | |