Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02346971
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 |
259![]() | 1-(methylsulfanyl)-4-nitrobenzene | X | 2RAZ | 0.86 | ![]() |
SBN![]() | 2-AMINO-6-(3,5-DIMETHYLPHENYL)SULFONYLBENZONITRILE | A | 1JLQ | 0.71 | ![]() |
NIT![]() | 4-NITROANILINE | C,D | 1RMH | 0.71 | ![]() |
NIT![]() | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.71 | ![]() |
NIT![]() | 4-NITROANILINE | B | 1VBS | 0.71 | ![]() |
NIT![]() | 4-NITROANILINE | C | 1V9T | 0.71 | ![]() |
NIT![]() | 4-NITROANILINE | C,D | 1VBT | 0.71 | ![]() |
NIT![]() | 4-NITROANILINE | B | 1LOP | 0.71 | ![]() |
NIT![]() | 4-NITROANILINE | C,D | 1ZKF | 0.71 | ![]() |
NIT![]() | 4-NITROANILINE | B | 1PIP | 0.71 | ![]() |
NPB![]() | 3-NITROPHENYLBORONIC ACID | A,B | 1KDS | 0.73 | ![]() |
D3F![]() | 2-[(2,4-DICHLORO-5-METHYLPHENYL)SULFONYL]- 1,3-DINITRO-5-(TRIFLUOROMETHYL)BENZENE | A | 2GZ7 | 0.71 | ![]() |
ISO![]() | PARA-ISOPROPYLANILINE | A | 1BMA | 0.7 | ![]() |
ISO![]() | PARA-ISOPROPYLANILINE | A,B | 1ELC | 0.7 | ![]() |
ISO![]() | PARA-ISOPROPYLANILINE | A,B | 1ELB | 0.7 | ![]() |
ISO![]() | PARA-ISOPROPYLANILINE | A,B | 1ELA | 0.7 | ![]() |
34A![]() | 3,4-DIMETHYLANILINE | A | 1L4K | 0.7 | ![]() |
4NM![]() | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.85 | ![]() |
3NT![]() | 3-NITROTOLUENE | A,B | 2BMR | 0.82 | ![]() |
3NT![]() | 3-NITROTOLUENE | A,B | 2HMO | 0.82 | ![]() |
PRY![]() | 2-PROPYL-ANILINE | A | 1OWY | 0.71 | ![]() |
53N![]() | 3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid | A | 3DN5 | 0.71 | ![]() |
PNZ![]() | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.79 | ![]() |
PNZ![]() | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.79 | ![]() |
TNL![]() | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.78 | ![]() |
NIN![]() | DINITROPHENYLENE | A | 1RSM | 0.71 | ![]() |
NIN![]() | DINITROPHENYLENE | A | 1GVY | 0.71 | ![]() |
NIN![]() | DINITROPHENYLENE | A | 1GW1 | 0.71 | ![]() |
NBZ![]() | NITROBENZENE | A,B | 2BMQ | 0.74 | ![]() |
NBZ![]() | NITROBENZENE | A,B | 3BGU | 0.74 | ![]() |
NHP![]() | 4-(2-AMINOPHENYLTHIO)-BUTYLPHOSPHONIC ACID | A,B | 1CX9 | 0.71 | ![]() |
UA5![]() | (4-ETHYLPHENYL)SULFAMIC ACID | A,B | 2I5X | 0.72 | ![]() |