Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02197562
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 |
5PP | 5-PENTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B36 | 0.71 | |
8PS | 5-OCTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B37 | 0.71 | |
MPP | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.74 | |
DCN | DICLOSAN | A,B,C,D | 2PD4 | 0.72 | |
TON | 2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL | A,B | 1SEZ | 0.72 | |
EPL | DIETHYL 4-METHOXYPHENYL PHOSPHATE | A | 2R1N | 0.8 | |
4BR | 2-(4-METHYLPHENOXY)ETHYLPHOSPHINATE | A | 1PE7 | 0.74 | |
TRT | FRAGMENT OF TRITON X-100 | A,E | 2I0U | 0.73 | |
TRT | FRAGMENT OF TRITON X-100 | A,B | 1OIZ | 0.73 | |
261 | 2-ethoxyphenol | X | 2RB1 | 0.85 | |
ZHH | 2-(4-METHOXYPHENYL)ETHANAMINE | D,H | 2HKR | 0.71 | |
268 | 2-phenoxyethanol | A | 2RBR | 0.84 | |
3FA | 3-FLUOROBENZENE-1,2-DIOL | A | 2AS4 | 0.71 | |
POT | (1S)-1-(PHENOXYMETHYL)PROPYL METHYLPHOSPHONOCHLORIDOATE | A | 2NW6 | 0.8 | |
GMN | 2,2',2"-[1,2,3-BENZENE-TRIYLTRIS(OXY)]TRIS[N,N,N- TRIETHYLETHANAMINIUM] | A,B | 1N5M | 0.73 | |
INK | (RP,SP)-O-(2R)-(1-PHENOXYBUT-2- YL)-METHYLPHOSPHONIC ACID CHLORIDE | A | 1HQD | 0.8 | |
IOL | 4-IODOPHENOL | A,B | 1EWA | 0.74 | |
BOP | 1-BROMO-4-METHOXYBENZENE | C,F | 1RHQ | 0.78 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.8 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.8 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.8 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.8 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.8 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.8 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.8 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.8 | |
CAQ | CATECHOL | B | 2BUY | 0.74 | |
CAQ | CATECHOL | A | 1KND | 0.74 | |
CAQ | CATECHOL | B | 2BUQ | 0.74 | |
CAQ | CATECHOL | A,B | 1DLT | 0.74 | |
CAQ | CATECHOL | A | 1XEP | 0.74 | |
CAQ | CATECHOL | A | 2PUM | 0.74 | |
IPH | PHENOL | A,B | 2OLD | 0.71 | |
IPH | PHENOL | A,B,C,D | 2PZV | 0.71 | |
IPH | PHENOL | A | 1LI2 | 0.71 | |
IPH | PHENOL | A | 2J9N | 0.71 | |
IPH | PHENOL | A,B,C,D | 2OMB | 0.71 | |
IPH | PHENOL | A | 1JHX | 0.71 | |
IPH | PHENOL | A,B,C,D | 2VE7 | 0.71 | |
IPH | PHENOL | B,D,E,G,H,J,L | 1AI0 | 0.71 | |
IPH | PHENOL | A,B,C,D | 1FOH | 0.71 | |
IPH | PHENOL | A | 1V03 | 0.71 | |
IPH | PHENOL | A,C,E,G,I,K | 5AIY | 0.71 | |
IPH | PHENOL | B,D,F,H,J,L | 1AIY | 0.71 | |
IPH | PHENOL | A,B | 1XU5 | 0.71 | |
IPH | PHENOL | A,B,C,D,E,G, I,K | 1W8P | 0.71 | |
IPH | PHENOL | A,C,E,G,I,K | 4AIY | 0.71 | |
IPH | PHENOL | A,B,C,D,E,F, G,H | 1XDA | 0.71 | |
IPH | PHENOL | A | 2AS3 | 0.71 | |
IPH | PHENOL | A,B,C,D | 1ZEG | 0.71 | |
IPH | PHENOL | A,B,C,D | 1PN0 | 0.71 | |
IPH | PHENOL | A,B,C,D | 1XW7 | 0.71 | |
IPH | PHENOL | A,C,E,G,I,K,M | 1QIY | 0.71 | |
IPH | PHENOL | A,B,C,D | 1Q4V | 0.71 | |
IPH | PHENOL | B | 1AI7 | 0.71 | |
IPH | PHENOL | A | 1FJW | 0.71 | |
IPH | PHENOL | B,C,D | 1RWE | 0.71 | |
IPH | PHENOL | A,B,C,D,E,G, H,I,K | 1ZNJ | 0.71 | |
IPH | PHENOL | B,C,D | 3GKY | 0.71 | |
IPH | PHENOL | A | 1JHY | 0.71 | |
IPH | PHENOL | A,C,E,G,I,K | 3AIY | 0.71 | |
IPH | PHENOL | A,B | 2OMN | 0.71 | |
IPH | PHENOL | A,C,E,G,I,K | 2AIY | 0.71 | |
IPH | PHENOL | A,B,D | 1MPJ | 0.71 | |
IPH | PHENOL | A,B,C,D,F,G, H,J | 1WAV | 0.71 | |
IPH | PHENOL | B,C,D | 1LPH | 0.71 | |
HFL | 5-(3,3-DIHYDROXYPROPENY)-3-METHOXY- BENZENE-1,2-DIOL | C,F | 1KYW | 0.71 | |
DBA | (2,6-DIMETHYL-PHENOXY)-ACETIC ACID | A,B | 1IDB | 0.7 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,C,E | 1KYZ | 0.74 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1JT2 | 0.74 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 6ATJ | 0.74 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1GKL | 0.74 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GWT | 0.74 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B,C | 2BJH | 0.74 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GW2 | 0.74 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 3CBG | 0.74 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 2BNJ | 0.74 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1UWC | 0.74 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 7ATJ | 0.74 | |
PZM | 1-(4-METHOXYPHENYL)METHANAMINE | A,D,H | 2HJB | 0.7 | |
4HM | 4-HYDROPEROXY-2-METHOXY-PHENOL | A | 1HU9 | 0.78 | |
PSY | phenyl ethenesulfonate | A | 3BM8 | 0.71 | |
PSY | phenyl ethenesulfonate | A | 3BLT | 0.71 | |
258 | (2-chloroethoxy)benzene | X | 2RAY | 0.79 | |
4FE | (2E)-3-(3-hydroxy-4-methoxyphenyl)prop- 2-enoic acid | A | 3CBG | 0.74 | |
MSB | 1-METHYLOXY-4-SULFONE-BENZENE | A | 1EUB | 0.78 | |
MSB | 1-METHYLOXY-4-SULFONE-BENZENE | A | 1BM6 | 0.78 |