Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00016024
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 |
XY2 | N,N'-DIMETHYL-N-(ACETYL)-N'-(7- NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE | X | 2CL7 | 0.77 |  |
| XY2 | N,N'-DIMETHYL-N-(ACETYL)-N'-(7- NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE | X | 2CL6 | 0.77 | |
| XY2 | N,N'-DIMETHYL-N-(ACETYL)-N'-(7- NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE | X | 2CE2 | 0.77 | |
| XY2 | N,N'-DIMETHYL-N-(ACETYL)-N'-(7- NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE | X | 2EVW | 0.77 | |
| XY2 | N,N'-DIMETHYL-N-(ACETYL)-N'-(7- NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE | X | 2CL0 | 0.77 | |
| XY2 | N,N'-DIMETHYL-N-(ACETYL)-N'-(7- NITROBENZ-2-OXA-1,3-DIAZOL-4-YL)ETHYLENEDIAMINE | X | 2CLC | 0.77 | |
T2D | 1,2,5-THIADIAZOLIDIN-3-ONE-1,1- DIOXIDE | A | 2BGE | 0.72 | |
01W | (2S)-2-ammonio-4-[(2,4-dinitrophenyl)amino]butanoate | A,B | 3DS9 | 0.83 | |
CB1 | 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE | A,B | 1XI2 | 0.72 | |
| CB1 | 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE | A,B | 1ZX1 | 0.72 | |
| CB1 | 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE | A,B | 1IDT | 0.72 | |
| CB1 | 5-(AZIRIDIN-1-YL)-2,4-DINITROBENZAMIDE | A,B | 2BZS | 0.72 | |
ONP | O-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE | A | 1D0Y | 0.74 | |
NPP | N-(2-AMINO-ETHYL)-4,6-DINITRO-N'- (2,2,6,6-TETRAMETHYL-1-OXY-PIPERIDIN- 4-YL)-BENZENE-1,3-DIAMINE | L | 1BAF | 0.81 | |
NP2 | N-(3-AMINOPROPYL)-2-NITROBENZENAMINE | A | 1WUM | 0.84 | |
MNQ | M-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE | A | 1D0X | 0.73 | |
BAN | HONH-BENZYLMALONYL-L-ALANYLGLYCINE- P-NITROANILIDE | A | 5TLN | 0.73 | |
HFT | HYDROXYFLUTAMIDE | A | 2AX6 | 0.74 | |
PNQ | P-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE | A | 1D0Z | 0.71 | |
DAQ | O,P-DINITROPHENYL AMINOPROPYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE | A | 1D1B | 0.78 | |
NIN | DINITROPHENYLENE | A | 1RSM | 0.73 | |
| NIN | DINITROPHENYLENE | A | 1GVY | 0.73 | |
| NIN | DINITROPHENYLENE | A | 1GW1 | 0.73 | |
FQX | [1,2,5]oxadiazolo[3,4-g]quinoxaline- 6,7(5H,8H)-dione 1-oxide | B,C,D,P | 3BKI | 0.73 | |
BHM | (R)-3-BROMO-2-HYDROXY-2-METHYL- N-[4-NITRO-3-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE | A | 2AX9 | 0.71 | |
EOB | {1,3-PHENYLENEBIS[IMINO(2-OXOETHANE- 2,1-DIYL)]}BIS(PHOSPHONIC ACID) | A,B,C,D | 2FZG | 0.76 | |
SG1 | 3-NITRO-4-(2-OXO-PYRROLIDIN-1-YL)- BENZENESULFONAMIDE | A | 1KWQ | 0.72 | |
IAP | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A | 1S6R | 0.76 | |
| IAP | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A,B | 1K6S | 0.76 | |
NMQ | N-METHYL O-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE | A | 1D1C | 0.72 | |
NP1 | N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE | A | 1WUG | 0.79 | |
DAE | O,P-DINITROPHENYL AMINOETHYLDIPHOSPHATE- BERYLLIUM TRIFLUORIDE | A | 1D1A | 0.77 | |
SHH | OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE | A | 1C3S | 0.76 | |
| SHH | OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE | A,B,C | 3C0Z | 0.76 | |
| SHH | OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE | A | 1T69 | 0.76 | |
| SHH | OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE | A,B,C,D | 1ZZ1 | 0.76 | |
NIT | 4-NITROANILINE | C,D | 1RMH | 0.73 | |
| NIT | 4-NITROANILINE | A,B,D,F,G,H,I | 2IXP | 0.73 | |
| NIT | 4-NITROANILINE | B | 1VBS | 0.73 | |
| NIT | 4-NITROANILINE | C | 1V9T | 0.73 | |
| NIT | 4-NITROANILINE | C,D | 1VBT | 0.73 | |
| NIT | 4-NITROANILINE | B | 1LOP | 0.73 | |
| NIT | 4-NITROANILINE | C,D | 1ZKF | 0.73 | |
| NIT | 4-NITROANILINE | B | 1PIP | 0.73 | |
PHJ | N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE | A,B | 1UR9 | 0.73 | |