Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00005591
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 |
2AC | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.8 | |
2AC | 2-AMINO-P-CRESOL | A | 1L4M | 0.8 | |
D3P | (2R)-AMINO(3,5-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.74 | |
D3P | (2R)-AMINO(3,5-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.74 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 1K03 | 0.7 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 2VQ5 | 0.7 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 1EB9 | 0.7 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 2GQ9 | 0.7 | |
HBA | P-HYDROXYBENZALDEHYDE | A,B | 1Z42 | 0.7 | |
HBA | P-HYDROXYBENZALDEHYDE | A | 1OYB | 0.7 | |
AZY | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.83 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 2BV0 | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A,B,D,F,H,J,L | 1YKP | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 1N8Q | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A,B | 2BSL | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKL | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D | 1B4U | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 3DX5 | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCA | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKN | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 1EOB | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 1PHH | 0.72 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 2BUV | 0.72 | |
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 | |
SHA | SALICYLHYDROXAMIC ACID | X | 1V0H | 0.74 | |
SHA | SALICYLHYDROXAMIC ACID | A | 2QPK | 0.74 | |
SHA | SALICYLHYDROXAMIC ACID | A | 3FNL | 0.74 | |
SHA | SALICYLHYDROXAMIC ACID | A | 3GCJ | 0.74 | |
SHA | SALICYLHYDROXAMIC ACID | A | 1CK6 | 0.74 | |
135 | N-(4-CARBAMIMIDOYL-PHENYL)-2-HYDROXY- BENZAMIDE | B | 1GJA | 0.7 | |
U14 | 3-(5-AMINO-3-IMINO-3H-PYRAZOL-4- YLAZO)-BENZOIC ACID | A | 2GG7 | 0.76 | |
PAB | 4-AMINOBENZOIC ACID | A | 1PBD | 0.8 | |
PAB | 4-AMINOBENZOIC ACID | B | 2DZA | 0.8 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUS | 0.8 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUU | 0.8 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUT | 0.8 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A,B | 1U1W | 0.85 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A | 1YFY | 0.85 | |
MHB | A,B | 1SRG | 0.8 | ||
EOZ | 3,5-BIS[(PHOSPHONOACETYL)AMINO]BENZOIC ACID | A,B,C,D | 2FZK | 0.7 | |
GHP | 4-HYDROXYPHENYLGLYCINE | A | 1DSR | 0.74 | |
NPC | 4-HYDROXY-3-NITROPHENYLACETYL-EPSILON- AMINOCAPROIC ACID ANION | H,I,J | 1A6V | 0.74 | |
MTB | A,B | 1SRF | 0.77 | ||
ICU | METHYL(2-ACETOXY-2-(2-CARBOXY-4- AMINO-PHENYL))ACETATE | A | 1JIM | 0.73 | |
DMB | A,B | 1SRI | 0.78 | ||
C00 | 2-(4-hydroxybiphenyl-3-yl)-4-methyl- 1H-isoindole-1,3(2H)-dione | A | 3BYX | 0.71 | |
C00 | 2-(4-hydroxybiphenyl-3-yl)-4-methyl- 1H-isoindole-1,3(2H)-dione | A | 3BZ0 | 0.71 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3GT4 | 0.73 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3E3T | 0.73 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3E3D | 0.73 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3E3S | 0.73 | |
I3C | 5-amino-2,4,6-triiodobenzene-1,3- dicarboxylic acid | A | 3E79 | 0.73 | |
IHB | 3-IODO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCI | 0.75 | |
2TY | 2-HYDROXY-5-{[(1E)-2-PHENYLETHYLIDENE]AMINO}- L-TYROSINE | A,B | 2CWV | 0.77 | |
4AA | 4-CHLORO-3-HYDROXYANTHRANILIC ACID | A | 1YFW | 0.76 | |
4AA | 4-CHLORO-3-HYDROXYANTHRANILIC ACID | A | 1YFX | 0.76 | |
DGH | (2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.74 | |
DGH | (2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.74 | |
DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1DOD | 0.72 | |
DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1DOE | 0.72 | |
DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1PBB | 0.72 | |
3B4 | 2-(cyclohexylamino)benzoic acid | A,B | 3B4P | 0.71 | |
NAB | A,B | 1SRJ | 0.74 | ||
3XH | 3-Hydroxyhippuric acid | A | 3E9K | 0.7 | |
TY2 | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.85 | |
LJ5 | N-(3,5-dibromo-4-hydroxyphenyl)benzamide | A,B | 3CN4 | 0.71 | |
YOF | 3-FLUOROTYROSINE | A,B | 1XIL | 0.72 | |
YOF | 3-FLUOROTYROSINE | A,B | 1XDC | 0.72 | |
YOF | 3-FLUOROTYROSINE | A | 1RRX | 0.72 | |
YOF | 3-FLUOROTYROSINE | A,B | 3FYG | 0.72 | |
BIE | (3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE | A,B | 2CL5 | 0.7 | |
FHB | 3-FLUORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCF | 0.75 | |
DB1 | 2,3-DIHYDROXYBENZAMIDE | A,B,C | 1X71 | 0.72 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A,B | 1BM7 | 0.71 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 1S2C | 0.71 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 2PIX | 0.71 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 3HF0 | 0.72 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 2OXK | 0.72 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A,B,C | 2OXJ | 0.72 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D,E,F, G,H | 1F8S | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | E,I | 1ZFP | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2HU8 | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 1AN9 | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2GVQ | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2YR6 | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,I | 1E8N | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 1ZYK | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A | 1C0I | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2JB3 | 0.8 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2E4A | 0.8 | |
HBD | 4-HYDROXYBENZAMIDE | B,C,D | 1BEN | 0.79 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | B,C | 2BNI | 0.72 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5K | 0.72 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5J | 0.72 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A,B | 2VJ1 | 0.71 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A | 2V6N | 0.71 | |
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.73 | |
MNY | 5,8-DI-AMINO-1,4-DIHYDROXY-ANTHRAQUINONE | A | 1M2R | 0.7 | |
ST2 | 4-(ACETYLAMINO)-5-AMINO-3-HYDROXYBENZOIC ACID | A,B | 1IVC | 0.75 | |
KYN | KYNURENINE | A,B,C,D | 2R2N | 0.7 | |
KYN | KYNURENINE | A,B | 3E2Z | 0.7 | |
KYN | KYNURENINE | A | 1XT7 | 0.7 | |
KYN | KYNURENINE | A | 1T5M | 0.7 | |
KYN | KYNURENINE | A | 1T5N | 0.7 | |
KYN | KYNURENINE | A | 2VOV | 0.7 | |
KYN | KYNURENINE | A | 2VOX | 0.7 | |
MCG | (S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE | A,B | 1ISS | 0.71 | |
NIP | 4-HYDROXY-5-IODO-3-NITROPHENYLACETYL- EPSILON-AMINOCAPROIC ACID ANION | H | 1A6W | 0.71 | |
ST3 | 4-(ACETYLAMINO)-3-AMINO BENZOIC ACID | A,B | 1IVE | 0.72 | |
247 | (3R)-3-amino-2,2-difluoro-3-(4- hydroxyphenyl)propanoic acid | A,B | 2QVE | 0.7 | |
IBR | A | 9EST | 0.7 | ||
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.86 | |
GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.86 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.86 | |
GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.86 | |
OFL | O-TRIFLUOROMETHYLPHENYL ANTHRANILIC ACID | A | 1DVZ | 0.71 | |
3HB | 3-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCB | 0.71 | |
3HB | 3-HYDROXYBENZOIC ACID | A | 2DKH | 0.71 | |
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 | |
SCL | ACETIC ACID SALICYLOYL-AMINO-ESTER | A | 1EBV | 0.74 | |
SX1 | 2-amino-5-bromobenzoic acid | A,B | 3CIZ | 0.74 | |
CHB | 3-CHLORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCH | 0.7 | |
HNA | 1,8-DI-HYDROXY-4-NITRO-ANTHRAQUINONE | A | 1M2P | 0.7 | |
KY1 | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.72 | |
NPA | 2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID | H | 1NGP | 0.79 | |
AHC | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.71 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBC | 0.82 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBF | 0.82 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1SXK | 0.82 | |
IYR | 3-IODO-TYROSINE | A | 2D98 | 0.72 | |
IYR | 3-IODO-TYROSINE | A | 2D8P | 0.72 | |
IYR | 3-IODO-TYROSINE | A,B | 3GFD | 0.72 | |
IYR | 3-IODO-TYROSINE | A | 2R1Q | 0.72 | |
IYR | 3-IODO-TYROSINE | A | 2ZP1 | 0.72 | |
IYR | 3-IODO-TYROSINE | A,B,C,D | 2ZXV | 0.72 | |
IYR | 3-IODO-TYROSINE | C | 1CF0 | 0.72 | |
IYR | 3-IODO-TYROSINE | A | 1XXZ | 0.72 | |
IYR | 3-IODO-TYROSINE | A | 2D97 | 0.72 | |
IYR | 3-IODO-TYROSINE | A | 1XY9 | 0.72 | |
IYR | 3-IODO-TYROSINE | A | 2Z10 | 0.72 | |
IYR | 3-IODO-TYROSINE | A | 1WQ3 | 0.72 | |
IYR | 3-IODO-TYROSINE | A | 2D8O | 0.72 | |
IYR | 3-IODO-TYROSINE | A | 2D8W | 0.72 | |
IYR | 3-IODO-TYROSINE | A | 2Z11 | 0.72 | |
HAB | A,B | 1SRE | 0.81 | ||
4MB | 4-[(METHYLSULFONYL)AMINO]BENZOIC ACID | A,B | 2HDS | 0.74 | |
D4P | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A | 1DSR | 0.74 | |
D4P | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.74 | |
D4P | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.74 | |
TYQ | 3-AMINO-6-HYDROXY-TYROSINE | A,B | 1D6Y | 0.83 | |
TYQ | 3-AMINO-6-HYDROXY-TYROSINE | A,B | 1D6U | 0.83 | |
NCR | 2-NITRO-P-CRESOL | A,B | 1AHV | 0.74 | |
2AF | 2-AMINOPHENOL | A | 1L4N | 0.74 | |
FDI | 4-(N-ACETYLAMINO)-3-[N-(2-ETHYLBUTANOYLAMINO)]BENZOIC ACID | A | 1B9S | 0.7 | |
MTY | META-TYROSINE | A | 2TOH | 0.71 | |
MTY | META-TYROSINE | A,B | 1BIQ | 0.71 | |
MTY | META-TYROSINE | A | 1Q7O | 0.71 | |
NIY | META-NITRO-TYROSINE | A | 2ADP | 0.79 | |
NIY | META-NITRO-TYROSINE | A | 3DIV | 0.79 | |
NIY | META-NITRO-TYROSINE | A | 2H5U | 0.79 | |
NIY | META-NITRO-TYROSINE | A | 1K4Q | 0.79 | |
NIY | META-NITRO-TYROSINE | B,G,O,Y | 1SDA | 0.79 | |
OBA | 2-(OXALYL-AMINO)-BENZOIC ACID | A | 1C85 | 0.71 | |
4A3 | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.88 | |
DMC | 3-(4-DIETHYLAMINO-2-HYDROXY-PHENYL)- 2-METHYL-PROPIONIC ACID | G | 4GCH | 0.7 | |
SGI | 3-(4-hydroxyphenyl)propanamide | A,B | 2R9K | 0.7 | |
4NL | 4-AMINOPHENOL | A | 2ORL | 0.71 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ4 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOB | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXB | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1G1B | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1YKJ | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUV | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PBE | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCC | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PDH | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUW | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC4 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC6 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUW | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1FW9 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1G81 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGJ | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUX | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ3 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1D7L | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 2PHH | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGN | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXA | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOC | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1K0I | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BKW | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1JD3 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXC | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1TT8 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ2 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1Q4S | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BF3 | 0.77 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUR | 0.77 | |
DTY | D-TYROSINE | A | 1C4B | 0.73 | |
DTY | D-TYROSINE | A,L | 1ZEA | 0.73 | |
DTY | D-TYROSINE | A,B,C,D,E,F, G,H | 1OF6 | 0.73 | |
DTY | D-TYROSINE | A,B | 1UNO | 0.73 | |
DTY | D-TYROSINE | A | 2IGZ | 0.73 | |
DTY | D-TYROSINE | A,B,C,H,K,L | 2R5D | 0.73 | |
DTY | D-TYROSINE | A,B | 2Q33 | 0.73 | |
DTY | D-TYROSINE | H,S | 2H9E | 0.73 | |
DTY | D-TYROSINE | A,B,C,H,K,L | 2R5B | 0.73 | |
DTY | D-TYROSINE | A | 2IH0 | 0.73 | |
DTY | D-TYROSINE | A | 1D7T | 0.73 | |
DTY | D-TYROSINE | A,B | 1XA0 | 0.73 | |
HTC | 3-{[(4-CARBOXY-2-HYDROXYANILINE]SULFONYL}THIOPHENE- 2-CARBOXYLIC ACID | A,B | 1XGJ | 0.71 |