Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00716418
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 |
SMA | STIGMATELLIN A | A,C,D,E,N,P, Q,R | 3H1I | 0.71 |  |
| SMA | STIGMATELLIN A | A,B,C,D,E,F, G,O,P,Q,R,S,T | 1PPJ | 0.71 | |
| SMA | STIGMATELLIN A | A,C,D,E,L,N, O,P,W | 3CXH | 0.71 | |
| SMA | STIGMATELLIN A | C,D,E,P,Q,R | 1ZRT | 0.71 | |
| SMA | STIGMATELLIN A | C,H,L,M | 2JBL | 0.71 | |
| SMA | STIGMATELLIN A | A,B,C,D,E,F, G,I,N,O,P,Q, R,S,T,U,V,W | 2A06 | 0.71 | |
| SMA | STIGMATELLIN A | A,B,C,D,E,F, G,H,I,J,K,L | 2QJP | 0.71 | |
| SMA | STIGMATELLIN A | A,C,D,E | 1KB9 | 0.71 | |
| SMA | STIGMATELLIN A | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R | 2QJK | 0.71 | |
| SMA | STIGMATELLIN A | A,B,C,D,E,F, G,N,O,P,Q,R, S,T | 1PP9 | 0.71 | |
| SMA | STIGMATELLIN A | C,D,E | 2IBZ | 0.71 | |
| SMA | STIGMATELLIN A | A,C,D,E,L,N, O,P,W | 3CX5 | 0.71 | |
| SMA | STIGMATELLIN A | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R | 2FYN | 0.71 | |
| SMA | STIGMATELLIN A | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R | 2QJY | 0.71 | |
| SMA | STIGMATELLIN A | C,D,E | 1EZV | 0.71 | |
| SMA | STIGMATELLIN A | C,D,E,N,O,P,W | 1KYO | 0.71 | |
| SMA | STIGMATELLIN A | A,C,D,E,G,N, P,Q,R,S | 3H1J | 0.71 | |
| SMA | STIGMATELLIN A | C,D,E | 1SQX | 0.71 | |
V55 | 4-hydroxy-3-methoxybenzaldehyde | B,D,E,F | 2VSS | 0.87 | |
| V55 | 4-hydroxy-3-methoxybenzaldehyde | A,B,D,E,F | 2VSU | 0.87 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | B,C,D | 2VK0 | 0.72 | |
| MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | A,B,D | 3MTH | 0.72 | |
300 | 2-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATE | A | 1O41 | 0.8 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.75 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.75 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.75 | |
| ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.75 | |
| ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.75 | |
FLN | 2-PHENYL-4H-CHROMEN-4-ONE | A | 2G0L | 0.72 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.79 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A,B,C,D | 2AHC | 0.78 | |
| VNL | 4-HYDROXY-3-METHOXYBENZOATE | A | 1XLR | 0.78 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 1K03 | 0.73 | |
| HBA | P-HYDROXYBENZALDEHYDE | A,B | 2VQ5 | 0.73 | |
| HBA | P-HYDROXYBENZALDEHYDE | A,B | 1EB9 | 0.73 | |
| HBA | P-HYDROXYBENZALDEHYDE | A | 2GQ9 | 0.73 | |
| HBA | P-HYDROXYBENZALDEHYDE | A,B | 1Z42 | 0.73 | |
| HBA | P-HYDROXYBENZALDEHYDE | A | 1OYB | 0.73 | |
HIB | 4-HYDROXY-5-IODO-2,3-DIMETHOXY- 6-METHYLBENZOIC ACID | A | 2PIK | 0.7 | |
SIG | STIGMATELLIN | C,D,E | 2BCC | 0.71 | |
| SIG | STIGMATELLIN | C,D,E | 3BCC | 0.71 | |
VXX | VANILLATE | A,B | 1WB6 | 0.79 | |
SYR | SYRINGATE | A,B | 1WB5 | 0.77 | |
MAX | MATAIRESINOL | A | 2BGM | 0.7 | |
BZF | BENZOFURAN | A | 182L | 0.72 | |
SB8 | 2-(3-BENZOYLPHENOXY)ETHYL(HYDROXY)FORMAMIDE | A | 2AIA | 0.7 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.71 | |
| AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.71 | |
3MB | 3-METHOXYBENZAMIDE | A | 3PAX | 0.74 | |
4FE | (2E)-3-(3-hydroxy-4-methoxyphenyl)prop- 2-enoic acid | A | 3CBG | 0.73 | |
MGI | methyl 4-(2,3-dihydroxy-5-methylphenoxy)- 2-hydroxy-6-methylbenzoate | A | 2ZA0 | 0.72 | |
AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3GCL | 0.72 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2QQT | 0.72 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1TGM | 0.72 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 2G5J | 0.72 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 1OXR | 0.72 | |
| AIN | 2-(ACETYLOXY)BENZOIC ACID | A | 3HWY | 0.72 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2QZZ | 0.72 | |
| EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2R2G | 0.72 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.7 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,C,E | 1KYZ | 0.73 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1JT2 | 0.73 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 6ATJ | 0.73 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1GKL | 0.73 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GWT | 0.73 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B,C | 2BJH | 0.73 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GW2 | 0.73 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 3CBG | 0.73 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 2BNJ | 0.73 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1UWC | 0.73 | |
| FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 7ATJ | 0.73 | |
MPP | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.76 | |
TDS | 8-HYDROXY-5,7-DIMETHOXY-3-METHYL- 2-TRIDECYL-4H-CHROMEN-4-ONE | A,B,C,D,L,R | 1Q90 | 0.72 | |
| TDS | 8-HYDROXY-5,7-DIMETHOXY-3-METHYL- 2-TRIDECYL-4H-CHROMEN-4-ONE | A,B,C,D,G | 2E76 | 0.72 | |
| TDS | 8-HYDROXY-5,7-DIMETHOXY-3-METHYL- 2-TRIDECYL-4H-CHROMEN-4-ONE | A,B,C,D,E,N, O,P,Q,R | 1VF5 | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.71 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.71 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.71 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.71 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.71 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.71 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.71 | |
| EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.71 | |
23A | 2,3-DIHYDROXYBENZALDEHYDE | A,B,C,D | 2DVX | 0.71 | |