Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02661536
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 |
3NT![]() | 3-NITROTOLUENE | A,B | 2BMR | 0.84 | ![]() |
3NT![]() | 3-NITROTOLUENE | A,B | 2HMO | 0.84 | ![]() |
3AB![]() | 3-aminobenzamide | A,B,C,D | 3GOY | 0.72 | ![]() |
4NM![]() | 4-NITROPHENYL METHANETHIOL | A,B | 2VO4 | 0.77 | ![]() |
GW9![]() | 2-chloro-5-nitro-N-phenylbenzamide | A,D | 3E00 | 0.7 | ![]() |
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 | ![]() |
PNZ![]() | P-NITRO-BENZYLAMINE | A,D,H | 2HJ4 | 0.78 | ![]() |
PNZ![]() | P-NITRO-BENZYLAMINE | A,B | 2C70 | 0.78 | ![]() |
MNP![]() | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.71 | ![]() |
NTD![]() | 2-{HYDROXY[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]METHYLENE}CYCLOHEXANE- 1,3-DIONE | A,B | 1T47 | 0.72 | ![]() |
XYD![]() | 2,5-DIMETHYLANILINE | A,B,C,D | 1KYA | 0.72 | ![]() |
XYD![]() | 2,5-DIMETHYLANILINE | A | 1L4L | 0.72 | ![]() |
PRY![]() | 2-PROPYL-ANILINE | A | 1OWY | 0.71 | ![]() |
NIN![]() | DINITROPHENYLENE | A | 1RSM | 0.71 | ![]() |
NIN![]() | DINITROPHENYLENE | A | 1GVY | 0.71 | ![]() |
NIN![]() | DINITROPHENYLENE | A | 1GW1 | 0.71 | ![]() |
NBZ![]() | NITROBENZENE | A,B | 2BMQ | 0.75 | ![]() |
NBZ![]() | NITROBENZENE | A,B | 3BGU | 0.75 | ![]() |
TNL![]() | 2,4,6-TRINITROTOLUENE | A | 1GVR | 0.77 | ![]() |
TNS![]() | A,B,L | 2G2R | 0.72 | ![]() | |
EBW![]() | 4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}- 3-OXOPENTYL)-N,N-DIMETHYL-N-PROP- 2-ENYLBENZENAMINIUM | A | 1E3Q | 0.71 | ![]() |
NID![]() | 4-NITRO-INDEN-1-ONE | A,B | 1DOH | 0.8 | ![]() |
AAN![]() | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.72 | ![]() |
34A![]() | 3,4-DIMETHYLANILINE | A | 1L4K | 0.71 | ![]() |