Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01631662
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 |
DH2![]() | (2S,3S)-2-(3,4-DIHYDROXYPHENYL)- 3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H- CHROMEN-4-ONE | A | 1GP5 | 0.71 | ![]() |
DH2![]() | (2S,3S)-2-(3,4-DIHYDROXYPHENYL)- 3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H- CHROMEN-4-ONE | A | 1GP6 | 0.71 | ![]() |
VXX![]() | VANILLATE | A,B | 1WB6 | 0.7 | ![]() |
MOB![]() | A,B | 1SRH | 0.7 | ![]() | |
TMS![]() | N-PROPYL-4-[(E)-2-(3,4,5-TRIMETHOXY- PHENYL)-VINYL]-BENZAMIDE | A,B | 1X6W | 0.76 | ![]() |
ERD![]() | (2S)-2-(3,4-DIHYDROXYPHENYL)-5,7- DIHYDROXY-2,3-DIHYDRO-4H-CHROMEN- 4-ONE | D,F | 2NNL | 0.71 | ![]() |
L41![]() | {4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acid | A,B | 3D5F | 0.7 | ![]() |
FSE![]() | 3,7,3',4'-TETRAHYDROXYFLAVONE | B | 1XO2 | 0.71 | ![]() |
4BB![]() | 4-tert-butyl-N'-[(1E)-(3,5-dibromo- 2,4-dihydroxyphenyl)methylidene]benzohydrazide | A,B,C,D,E,F | 3DP3 | 0.73 | ![]() |
DQH![]() | (2R,3R)-2-(3,4-DIHYDROXYPHENYL)- 3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H- CHROMEN-4-ONE | A | 1GP5 | 0.71 | ![]() |
DQH![]() | (2R,3R)-2-(3,4-DIHYDROXYPHENYL)- 3,5,7-TRIHYDROXY-2,3-DIHYDRO-4H- CHROMEN-4-ONE | D,F | 2C29 | 0.71 | ![]() |
3BE![]() | 3-bromo-N'-[(1E)-(3,5-dibromo-2,4- dihydroxyphenyl)methylidene]benzohydrazide | A,B,C,D,E,F | 3DOZ | 0.74 | ![]() |
HWG![]() | N-(TERT-BUTYL)-3,5-DIMETHYL-N'- [(5-METHYL-2,3-DIHYDRO-1,4-BENZODIOXIN- 6-YL)CARBONYL]BENZOHYDRAZIDE | A,D | 1R20 | 0.77 | ![]() |
AI1![]() | N-BENZYL-3-(ALPHA-D-GALACTOS-1- YL)-BENZAMIDE | D,E,F,G,H,L, M,N,O,P | 1FD7 | 0.72 | ![]() |
MGI![]() | methyl 4-(2,3-dihydroxy-5-methylphenoxy)- 2-hydroxy-6-methylbenzoate | A | 2ZA0 | 0.74 | ![]() |
SYR![]() | SYRINGATE | A,B | 1WB5 | 0.72 | ![]() |
429![]() | 2-{4-[2-ACETYLAMINO-3-(4-CARBOXYMETHOXY- 3-HYDROXY-PHENYL)-PROPIONYLAMINO]- BUTOXY}-6-HYDROXY-BENZOIC ACID METHYL ESTER | A | 1QXK | 0.75 | ![]() |
4BE![]() | 4-bromo-N'-[(1E)-(3,5-dibromo-2,4- dihydroxyphenyl)methylidene]benzohydrazide | A,B,C,D,E,F | 3DP2 | 0.73 | ![]() |
1BA![]() | 4-HYDROXY-N'-(4-ISOPROPYLBENZYL)BENZOHYDRAZIDE | A | 2GPP | 0.71 | ![]() |
QUE![]() | 3,5,7,3',4'-PENTAHYDROXYFLAVONE | A,B,C,D,E,F | 3BXX | 0.7 | ![]() |
QUE![]() | 3,5,7,3',4'-PENTAHYDROXYFLAVONE | A | 2O3P | 0.7 | ![]() |
QUE![]() | 3,5,7,3',4'-PENTAHYDROXYFLAVONE | A,B | 2UXH | 0.7 | ![]() |
QUE![]() | 3,5,7,3',4'-PENTAHYDROXYFLAVONE | A | 1GP6 | 0.7 | ![]() |
QUE![]() | 3,5,7,3',4'-PENTAHYDROXYFLAVONE | A | 2C9Z | 0.7 | ![]() |
QUE![]() | 3,5,7,3',4'-PENTAHYDROXYFLAVONE | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2JJ2 | 0.7 | ![]() |
QUE![]() | 3,5,7,3',4'-PENTAHYDROXYFLAVONE | A | 3BPT | 0.7 | ![]() |
QUE![]() | 3,5,7,3',4'-PENTAHYDROXYFLAVONE | A,B,C,D,E,F | 3CF8 | 0.7 | ![]() |
QUE![]() | 3,5,7,3',4'-PENTAHYDROXYFLAVONE | A,B | 2HCK | 0.7 | ![]() |
QUE![]() | 3,5,7,3',4'-PENTAHYDROXYFLAVONE | A,B,C,D | 1H1I | 0.7 | ![]() |
QUE![]() | 3,5,7,3',4'-PENTAHYDROXYFLAVONE | A | 1E8W | 0.7 | ![]() |
2RB![]() | N'-[(1E)-(3,5-dibromo-2,4-dihydroxyphenyl)methylidene]- 4-methoxybenzohydrazide | A,B,C,D,E,F | 3DP1 | 0.82 | ![]() |
FLQ![]() | N-[6-(ACETYLAMINO)HEXYL]-3',6'- DIHYDROXY-3-OXO-3H-SPIRO[2-BENZOFURAN- 1,9'-XANTHENE]-6-CARBOXAMIDE | C | 2FDC | 0.71 | ![]() |
GL8![]() | GALANTHAMINE DERIVATIVE | A | 1W4L | 0.72 | ![]() |
K05![]() | (E)-3,4-DIHYDROXY-N'-[(2-METHOXYNAPHTHALEN- 1-YL)METHYLENE]BENZOHYDRAZIDE | A,B | 2I5J | 0.85 | ![]() |
SIG![]() | STIGMATELLIN | C,D,E | 2BCC | 0.72 | ![]() |
SIG![]() | STIGMATELLIN | C,D,E | 3BCC | 0.72 | ![]() |
SMA![]() | STIGMATELLIN A | A,C,D,E,N,P, Q,R | 3H1I | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | A,B,C,D,E,F, G,O,P,Q,R,S,T | 1PPJ | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | A,C,D,E,L,N, O,P,W | 3CXH | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | C,D,E,P,Q,R | 1ZRT | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | C,H,L,M | 2JBL | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | A,B,C,D,E,F, G,I,N,O,P,Q, R,S,T,U,V,W | 2A06 | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | A,B,C,D,E,F, G,H,I,J,K,L | 2QJP | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | A,C,D,E | 1KB9 | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R | 2QJK | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | A,B,C,D,E,F, G,N,O,P,Q,R, S,T | 1PP9 | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | C,D,E | 2IBZ | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | A,C,D,E,L,N, O,P,W | 3CX5 | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R | 2FYN | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P,Q,R | 2QJY | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | C,D,E | 1EZV | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | C,D,E,N,O,P,W | 1KYO | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | A,C,D,E,G,N, P,Q,R,S | 3H1J | 0.73 | ![]() |
SMA![]() | STIGMATELLIN A | C,D,E | 1SQX | 0.73 | ![]() |
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 | ![]() |
MYF![]() | 5,7-DIHYDROXY-2-(3,4,5-TRIHYDROXYPHENYL)- 4H-CHROMEN-4-ONE | A | 2O65 | 0.7 | ![]() |