Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02845318
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 |
OA5![]() | 6-(2-phenoxyethoxy)-1,3,5-triazine- 2,4-diamine | A,B | 2W6Q | 0.7 | ![]() |
OXN![]() | OXTOXYNOL-10 | A | 1IKT | 0.7 | ![]() |
OXN![]() | OXTOXYNOL-10 | A,B | 2Q32 | 0.7 | ![]() |
OXN![]() | OXTOXYNOL-10 | A,B | 1UEH | 0.7 | ![]() |
OXN![]() | OXTOXYNOL-10 | A,B | 2D4Q | 0.7 | ![]() |
DCN![]() | DICLOSAN | A,B,C,D | 2PD4 | 0.74 | ![]() |
IPH![]() | PHENOL | A,B | 2OLD | 0.72 | ![]() |
IPH![]() | PHENOL | A,B,C,D | 2PZV | 0.72 | ![]() |
IPH![]() | PHENOL | A | 1LI2 | 0.72 | ![]() |
IPH![]() | PHENOL | A | 2J9N | 0.72 | ![]() |
IPH![]() | PHENOL | A,B,C,D | 2OMB | 0.72 | ![]() |
IPH![]() | PHENOL | A | 1JHX | 0.72 | ![]() |
IPH![]() | PHENOL | A,B,C,D | 2VE7 | 0.72 | ![]() |
IPH![]() | PHENOL | B,D,E,G,H,J,L | 1AI0 | 0.72 | ![]() |
IPH![]() | PHENOL | A,B,C,D | 1FOH | 0.72 | ![]() |
IPH![]() | PHENOL | A | 1V03 | 0.72 | ![]() |
IPH![]() | PHENOL | A,C,E,G,I,K | 5AIY | 0.72 | ![]() |
IPH![]() | PHENOL | B,D,F,H,J,L | 1AIY | 0.72 | ![]() |
IPH![]() | PHENOL | A,B | 1XU5 | 0.72 | ![]() |
IPH![]() | PHENOL | A,B,C,D,E,G, I,K | 1W8P | 0.72 | ![]() |
IPH![]() | PHENOL | A,C,E,G,I,K | 4AIY | 0.72 | ![]() |
IPH![]() | PHENOL | A,B,C,D,E,F, G,H | 1XDA | 0.72 | ![]() |
IPH![]() | PHENOL | A | 2AS3 | 0.72 | ![]() |
IPH![]() | PHENOL | A,B,C,D | 1ZEG | 0.72 | ![]() |
IPH![]() | PHENOL | A,B,C,D | 1PN0 | 0.72 | ![]() |
IPH![]() | PHENOL | A,B,C,D | 1XW7 | 0.72 | ![]() |
IPH![]() | PHENOL | A,C,E,G,I,K,M | 1QIY | 0.72 | ![]() |
IPH![]() | PHENOL | A,B,C,D | 1Q4V | 0.72 | ![]() |
IPH![]() | PHENOL | B | 1AI7 | 0.72 | ![]() |
IPH![]() | PHENOL | A | 1FJW | 0.72 | ![]() |
IPH![]() | PHENOL | B,C,D | 1RWE | 0.72 | ![]() |
IPH![]() | PHENOL | A,B,C,D,E,G, H,I,K | 1ZNJ | 0.72 | ![]() |
IPH![]() | PHENOL | B,C,D | 3GKY | 0.72 | ![]() |
IPH![]() | PHENOL | A | 1JHY | 0.72 | ![]() |
IPH![]() | PHENOL | A,C,E,G,I,K | 3AIY | 0.72 | ![]() |
IPH![]() | PHENOL | A,B | 2OMN | 0.72 | ![]() |
IPH![]() | PHENOL | A,C,E,G,I,K | 2AIY | 0.72 | ![]() |
IPH![]() | PHENOL | A,B,D | 1MPJ | 0.72 | ![]() |
IPH![]() | PHENOL | A,B,C,D,F,G, H,J | 1WAV | 0.72 | ![]() |
IPH![]() | PHENOL | B,C,D | 1LPH | 0.72 | ![]() |
TCL![]() | TRICLOSAN | A,B,C,D | 2PD3 | 0.71 | ![]() |
TCL![]() | TRICLOSAN | A,B | 1P45 | 0.71 | ![]() |
TCL![]() | TRICLOSAN | A,B,C,D,E,F | 2B35 | 0.71 | ![]() |
TCL![]() | TRICLOSAN | A,B | 1D8A | 0.71 | ![]() |
TCL![]() | TRICLOSAN | A,B | 1C14 | 0.71 | ![]() |
TCL![]() | TRICLOSAN | A,B,C,D | 2QIO | 0.71 | ![]() |
TCL![]() | TRICLOSAN | A,B | 1NHG | 0.71 | ![]() |
TCL![]() | TRICLOSAN | A | 1D7O | 0.71 | ![]() |
TCL![]() | TRICLOSAN | A,B,C,D | 2O2Y | 0.71 | ![]() |
TCL![]() | TRICLOSAN | A,B | 1UH5 | 0.71 | ![]() |
TCL![]() | TRICLOSAN | A,B | 2O2S | 0.71 | ![]() |
TCL![]() | TRICLOSAN | A,B,C,D | 1QG6 | 0.71 | ![]() |
TCL![]() | TRICLOSAN | A,B,C,D,E,F, G,H | 1QSG | 0.71 | ![]() |
TON![]() | 2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL | A,B | 1SEZ | 0.73 | ![]() |
DBA![]() | (2,6-DIMETHYL-PHENOXY)-ACETIC ACID | A,B | 1IDB | 0.71 | ![]() |
FP2![]() | 2-fluorophenol | A | 3CPO | 0.7 | ![]() |
CFA![]() | (2,4-DICHLOROPHENOXY)ACETIC ACID | B,E | 2P1N | 0.75 | ![]() |
TRT![]() | FRAGMENT OF TRITON X-100 | A,E | 2I0U | 0.74 | ![]() |
TRT![]() | FRAGMENT OF TRITON X-100 | A,B | 1OIZ | 0.74 | ![]() |
POT![]() | (1S)-1-(PHENOXYMETHYL)PROPYL METHYLPHOSPHONOCHLORIDOATE | A | 2NW6 | 0.83 | ![]() |
EPL![]() | DIETHYL 4-METHOXYPHENYL PHOSPHATE | A | 2R1N | 0.8 | ![]() |
TF5![]() | 2-[(2',3',4'-TRIFLUOROBIPHENYL- 2-YL)OXY]ETHANOL | A,B | 2OP3 | 0.72 | ![]() |
BR3![]() | (6-METHYL-3,4-DIHYDRO-2H-CHROMEN- 2-YL)METHYLPHOSPHINATE | A | 1PE5 | 0.72 | ![]() |
258![]() | (2-chloroethoxy)benzene | X | 2RAY | 0.98 | ![]() |
ZHH![]() | 2-(4-METHOXYPHENYL)ETHANAMINE | D,H | 2HKR | 0.71 | ![]() |
EGC![]() | 2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3- TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}- ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)- ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL | A,B | 1JP3 | 0.7 | ![]() |
EGC![]() | 2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3- TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}- ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)- ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL | A | 2W22 | 0.7 | ![]() |
MSB![]() | 1-METHYLOXY-4-SULFONE-BENZENE | A | 1EUB | 0.76 | ![]() |
MSB![]() | 1-METHYLOXY-4-SULFONE-BENZENE | A | 1BM6 | 0.76 | ![]() |
COU![]() | COUMARIN | A | 3CRB | 0.71 | ![]() |
COU![]() | COUMARIN | A | 2PMJ | 0.71 | ![]() |
COU![]() | COUMARIN | A | 2H90 | 0.71 | ![]() |
COU![]() | COUMARIN | A,B,C,D | 1Z10 | 0.71 | ![]() |
COU![]() | COUMARIN | A | 2PWB | 0.71 | ![]() |
4BR![]() | 2-(4-METHYLPHENOXY)ETHYLPHOSPHINATE | A | 1PE7 | 0.79 | ![]() |
ZZ1![]() | 4-METHYL-2H-CHROMEN-2-ONE | A | 2CIP | 0.72 | ![]() |
SC4![]() | 1[2-CHLORO-4-METHOXY-PHENYL-OXYMETHYL]- 4-[2,6-DICHLORO-PHENYL-OXYMETHYL]- BENZENE | 1,4 | 1EAH | 0.71 | ![]() |
SC4![]() | 1[2-CHLORO-4-METHOXY-PHENYL-OXYMETHYL]- 4-[2,6-DICHLORO-PHENYL-OXYMETHYL]- BENZENE | 1,4 | 3EPF | 0.71 | ![]() |
FPN![]() | 4-FLUOROPHENOL | A,B | 1XVD | 0.7 | ![]() |
2CH![]() | 2-CHLOROPHENOL | A | 1WBO | 0.71 | ![]() |
505![]() | (2R)-1-(2,6-dimethylphenoxy)propan- 2-amine | A | 2VIN | 0.71 | ![]() |
BOP![]() | 1-BROMO-4-METHOXYBENZENE | C,F | 1RHQ | 0.77 | ![]() |
268![]() | 2-phenoxyethanol | A | 2RBR | 0.88 | ![]() |
440![]() | 3-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}propane- 1-thiol | A | 3B92 | 0.73 | ![]() |
INK![]() | (RP,SP)-O-(2R)-(1-PHENOXYBUT-2- YL)-METHYLPHOSPHONIC ACID CHLORIDE | A | 1HQD | 0.83 | ![]() |
261![]() | 2-ethoxyphenol | X | 2RB1 | 0.81 | ![]() |
3CH![]() | 3-CHLOROPHENOL | A | 1LI3 | 0.7 | ![]() |
MLG![]() | N-[3-(2,4-DICHLOROPHENOXY)PROPYL]- N-METHYL-N-PROP-2-YNYLAMINE | A,B | 2BXR | 0.75 | ![]() |
MLG![]() | N-[3-(2,4-DICHLOROPHENOXY)PROPYL]- N-METHYL-N-PROP-2-YNYLAMINE | A,B | 2BXS | 0.75 | ![]() |
MLG![]() | N-[3-(2,4-DICHLOROPHENOXY)PROPYL]- N-METHYL-N-PROP-2-YNYLAMINE | A,B,C,D | 1O5W | 0.75 | ![]() |
PSY![]() | phenyl ethenesulfonate | A | 3BM8 | 0.71 | ![]() |
PSY![]() | phenyl ethenesulfonate | A | 3BLT | 0.71 | ![]() |
IOL![]() | 4-IODOPHENOL | A,B | 1EWA | 0.7 | ![]() |
LJ4![]() | 2,6-dibromo-4-phenoxyphenol | A,B | 3CN3 | 0.72 | ![]() |