Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00044622
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 |
4A3 | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.84 | |
DMB | A,B | 1SRI | 0.77 | ||
GHP | 4-HYDROXYPHENYLGLYCINE | A | 1DSR | 0.73 | |
135 | N-(4-CARBAMIMIDOYL-PHENYL)-2-HYDROXY- BENZAMIDE | B | 1GJA | 0.78 | |
MCG | (S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE | A,B | 1ISS | 0.7 | |
4MB | 4-[(METHYLSULFONYL)AMINO]BENZOIC ACID | A,B | 2HDS | 0.79 | |
MOB | A,B | 1SRH | 0.7 | ||
TYQ | 3-AMINO-6-HYDROXY-TYROSINE | A,B | 1D6Y | 0.7 | |
TYQ | 3-AMINO-6-HYDROXY-TYROSINE | A,B | 1D6U | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I2Z | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C | 1FIQ | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I30 | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1PTH | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3DEU | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C,D | 2E1Q | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3HGX | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3BPX | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1WYG | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1JGS | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | X | 1M6E | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 3B9M | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1FO4 | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1Y7I | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 2FN1 | 0.7 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.76 | |
GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.76 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.76 | |
GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.76 | |
MTB | A,B | 1SRF | 0.77 | ||
PAB | 4-AMINOBENZOIC ACID | A | 1PBD | 0.82 | |
PAB | 4-AMINOBENZOIC ACID | B | 2DZA | 0.82 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUS | 0.82 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUU | 0.82 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUT | 0.82 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBC | 0.93 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBF | 0.93 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1SXK | 0.93 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D,E,F, G,H | 1F8S | 0.76 | |
BE2 | 2-AMINOBENZOIC ACID | E,I | 1ZFP | 0.76 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2HU8 | 0.76 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 1AN9 | 0.76 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2GVQ | 0.76 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2YR6 | 0.76 | |
BE2 | 2-AMINOBENZOIC ACID | A,I | 1E8N | 0.76 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 1ZYK | 0.76 | |
BE2 | 2-AMINOBENZOIC ACID | A | 1C0I | 0.76 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2JB3 | 0.76 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2E4A | 0.76 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3S | 0.7 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B,C,D | 2H4B | 0.7 | |
SX1 | 2-amino-5-bromobenzoic acid | A,B | 3CIZ | 0.71 | |
MHB | A,B | 1SRG | 0.79 | ||
LJ5 | N-(3,5-dibromo-4-hydroxyphenyl)benzamide | A,B | 3CN4 | 0.71 | |
HAB | A,B | 1SRE | 0.78 | ||
NPA | 2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID | H | 1NGP | 0.74 | |
BIE | (3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE | A,B | 2CL5 | 0.72 | |
NAB | A,B | 1SRJ | 0.73 | ||
DGH | (2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.73 | |
DGH | (2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.73 | |
EAB | (3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3T | 0.7 | |
MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | A,B,C,D,I,J, K,L | 3EWF | 0.74 | |
MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | A,B,I,L | 2V5W | 0.74 | |
MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | B | 1VDN | 0.74 | |
MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | C | 1VAI | 0.74 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A,B | 2VJ1 | 0.76 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A | 2V6N | 0.76 | |
SCL | ACETIC ACID SALICYLOYL-AMINO-ESTER | A | 1EBV | 0.79 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | B,C | 2BNI | 0.77 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5K | 0.77 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5J | 0.77 | |
HTC | 3-{[(4-CARBOXY-2-HYDROXYANILINE]SULFONYL}THIOPHENE- 2-CARBOXYLIC ACID | A,B | 1XGJ | 0.7 | |
2AC | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.73 | |
2AC | 2-AMINO-P-CRESOL | A | 1L4M | 0.73 | |
TY2 | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.76 | |
ST2 | 4-(ACETYLAMINO)-5-AMINO-3-HYDROXYBENZOIC ACID | A,B | 1IVC | 0.75 | |
MNY | 5,8-DI-AMINO-1,4-DIHYDROXY-ANTHRAQUINONE | A | 1M2R | 0.78 | |
HNA | 1,8-DI-HYDROXY-4-NITRO-ANTHRAQUINONE | A | 1M2P | 0.72 | |
ST6 | 4-(ACETYLAMINO)-3-[(AMINOACETYL)AMINO]BENZOIC ACID | A,B | 1INH | 0.71 | |
DZ3 | N-(3,5-dibromo-4-hydroxyphenyl)- 4-hydroxy-3,5-dimethylbenzamide | A,B | 3ESP | 0.7 | |
HBD | 4-HYDROXYBENZAMIDE | B,C,D | 1BEN | 0.75 | |
AZY | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.75 | |
247 | (3R)-3-amino-2,2-difluoro-3-(4- hydroxyphenyl)propanoic acid | A,B | 2QVE | 0.72 | |
BFS | N-[1-(4-BROMOPHENYL)ETHYL]-5-FLUORO SALICYLAMIDE | A | 1STD | 0.7 | |
BFS | N-[1-(4-BROMOPHENYL)ETHYL]-5-FLUORO SALICYLAMIDE | A,B,C | 4STD | 0.7 | |
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.74 | |
A41 | 5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID | A | 1YW7 | 0.7 | |
ST1 | 4-(ACETYLAMINO)-3-HYDROXY-5-NITROBENZOIC ACID | A,B | 1IVD | 0.71 | |
ST1 | 4-(ACETYLAMINO)-3-HYDROXY-5-NITROBENZOIC ACID | A | 1IVB | 0.71 | |
AHC | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.71 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A,B | 1U1W | 0.76 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A | 1YFY | 0.76 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.71 | |
AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.71 | |
136 | N-(4-CARBAMIMIDOYL-3-CHORO-PHENYL)- 2-HYDROXY-3-IODO-5-METHYL-BENZAMIDE | B | 1GJD | 0.71 | |
SHA | SALICYLHYDROXAMIC ACID | X | 1V0H | 0.79 | |
SHA | SALICYLHYDROXAMIC ACID | A | 2QPK | 0.79 | |
SHA | SALICYLHYDROXAMIC ACID | A | 3FNL | 0.79 | |
SHA | SALICYLHYDROXAMIC ACID | A | 3GCJ | 0.79 | |
SHA | SALICYLHYDROXAMIC ACID | A | 1CK6 | 0.79 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 3HF0 | 0.71 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 2OXK | 0.71 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A,B,C | 2OXJ | 0.71 | |
SGI | 3-(4-hydroxyphenyl)propanamide | A,B | 2R9K | 0.72 | |
DMC | 3-(4-DIETHYLAMINO-2-HYDROXY-PHENYL)- 2-METHYL-PROPIONIC ACID | G | 4GCH | 0.77 | |
MTY | META-TYROSINE | A | 2TOH | 0.71 | |
MTY | META-TYROSINE | A,B | 1BIQ | 0.71 | |
MTY | META-TYROSINE | A | 1Q7O | 0.71 | |
GBS | 4-GUANIDINOBENZOIC ACID | X | 2AH4 | 0.73 | |
GBS | 4-GUANIDINOBENZOIC ACID | A | 1GBT | 0.73 | |
GBS | 4-GUANIDINOBENZOIC ACID | A | 1RTK | 0.73 | |
GBS | 4-GUANIDINOBENZOIC ACID | A | 3DFL | 0.73 | |
DB1 | 2,3-DIHYDROXYBENZAMIDE | A,B,C | 1X71 | 0.76 | |
KY1 | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.73 | |
D4P | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A | 1DSR | 0.73 | |
D4P | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.73 | |
D4P | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.73 | |
ICU | METHYL(2-ACETOXY-2-(2-CARBOXY-4- AMINO-PHENYL))ACETATE | A | 1JIM | 0.71 | |
BJH | 1(R)-1-ACETAMIDO-2-(3-CARBOXY-2- HYDROXYPHENYL)ETHYL BORONIC ACID | A | 1ERQ | 0.71 | |
FDI | 4-(N-ACETYLAMINO)-3-[N-(2-ETHYLBUTANOYLAMINO)]BENZOIC ACID | A | 1B9S | 0.72 | |
NIY | META-NITRO-TYROSINE | A | 2ADP | 0.71 | |
NIY | META-NITRO-TYROSINE | A | 3DIV | 0.71 | |
NIY | META-NITRO-TYROSINE | A | 2H5U | 0.71 | |
NIY | META-NITRO-TYROSINE | A | 1K4Q | 0.71 | |
NIY | META-NITRO-TYROSINE | B,G,O,Y | 1SDA | 0.71 | |
FEN | N-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDE | A | 1FEL | 0.7 | |
ST3 | 4-(ACETYLAMINO)-3-AMINO BENZOIC ACID | A,B | 1IVE | 0.73 |