Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01293051
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 |
555 | 4-(4-HYDROXYPHENYL)-1-NAPHTHALDEHYDE OXIME | A,B | 2NV7 | 0.74 | |
SMN | (S)-MANDELIC ACID | A | 1MDL | 0.72 | |
MBD | 3-METHYLCATECHOL | A | 1KNF | 0.73 | |
3HP | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.71 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.71 | |
LDP | L-DOPAMINE | A,B | 2A3R | 0.7 | |
LDP | L-DOPAMINE | A | 5PAH | 0.7 | |
LDP | L-DOPAMINE | A,B | 2QMZ | 0.7 | |
LDP | L-DOPAMINE | A,B | 2VQ5 | 0.7 | |
DTY | D-TYROSINE | A | 1C4B | 0.71 | |
DTY | D-TYROSINE | A,L | 1ZEA | 0.71 | |
DTY | D-TYROSINE | A,B,C,D,E,F, G,H | 1OF6 | 0.71 | |
DTY | D-TYROSINE | A,B | 1UNO | 0.71 | |
DTY | D-TYROSINE | A | 2IGZ | 0.71 | |
DTY | D-TYROSINE | A,B,C,H,K,L | 2R5D | 0.71 | |
DTY | D-TYROSINE | A,B | 2Q33 | 0.71 | |
DTY | D-TYROSINE | H,S | 2H9E | 0.71 | |
DTY | D-TYROSINE | A,B,C,H,K,L | 2R5B | 0.71 | |
DTY | D-TYROSINE | A | 2IH0 | 0.71 | |
DTY | D-TYROSINE | A | 1D7T | 0.71 | |
DTY | D-TYROSINE | A,B | 1XA0 | 0.71 | |
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.72 | |
MCT | 4-METHYLCATECHOL | A | 1L4G | 0.71 | |
MCT | 4-METHYLCATECHOL | A | 2EHZ | 0.71 | |
MCT | 4-METHYLCATECHOL | A,B | 1DMH | 0.71 | |
PCR | P-CRESOL | A | 1JHV | 0.71 | |
PCR | P-CRESOL | A | 1JHU | 0.71 | |
PCR | P-CRESOL | A,B,C,D | 1DIQ | 0.71 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 3HF0 | 0.7 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 2OXK | 0.7 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A,B,C | 2OXJ | 0.7 | |
2C2 | (2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID | A | 2IME | 0.71 | |
2C2 | (2S)-2-HYDROXY-2H-CHROMENE-2-CARBOXYLIC ACID | A | 2IMD | 0.71 | |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.73 | |
4HP | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.74 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.74 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.74 | |
4HP | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.74 | |
4HP | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.74 | |
OAC | TRANS-O-HYDROXY-ALPHA-METHYL CINNAMATE | C | 3GCH | 0.72 | |
2HC | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.79 | |
AEH | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.7 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B | 2TPL | 0.75 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B,C,D | 3GGP | 0.75 | |
DHC | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.75 | |
DHC | CAFFEIC ACID | A | 1KOU | 0.75 | |
OX5 | 4-HYDROXYBENZALDEHYDE O-(3,3-DIMETHYLBUTANOYL)OXIME | A,B,C | 2OOZ | 0.86 | |
CRS | M-CRESOL | A,B,C,D | 1EV3 | 0.7 | |
CRS | M-CRESOL | A,B,C,D,E,F | 2OMG | 0.7 | |
CRS | M-CRESOL | A,B | 1UZ9 | 0.7 | |
CRS | M-CRESOL | A,B,C,D | 1ZEH | 0.7 | |
CRS | M-CRESOL | A,B,C,D,E,F | 1ZEI | 0.7 | |
CRS | M-CRESOL | A,C,D,E | 7INS | 0.7 | |
CRS | M-CRESOL | A,B,C,D,E,G, I,K | 1EV6 | 0.7 | |
8PP | 2-[(2E,6E,10E,14E,18E,22E,26E)- 3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA- 2,6,10,14,18,22,26,30-OCTAENYL]PHENOL | A,B,C,D | 1Y0G | 0.71 | |
DBA | (2,6-DIMETHYL-PHENOXY)-ACETIC ACID | A,B | 1IDB | 0.72 | |
BPY | BIPHENYL-2,3-DIOL | A | 1KMY | 0.71 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW8 | 0.71 | |
BPY | BIPHENYL-2,3-DIOL | A | 2EI3 | 0.71 | |
BPY | BIPHENYL-2,3-DIOL | A | 1EIR | 0.71 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW6 | 0.71 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KWC | 0.71 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW9 | 0.71 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | H,I | 1A2C | 0.76 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C | 1CA7 | 0.76 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C,D | 3GGO | 0.76 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.75 | |
SN1 | 2,4-DIHYDROXY-TRANS CINNAMIC ACID | 1 | 1K2I | 0.75 | |
HC4 | A | 1TS6 | 0.76 | ||
HC4 | A | 3PHY | 0.76 | ||
HC4 | A | 3PYP | 0.76 | ||
HC4 | A | 1T1C | 0.76 | ||
HC4 | A | 1OT6 | 0.76 | ||
HC4 | A | 1TS0 | 0.76 | ||
HC4 | A | 1T1A | 0.76 | ||
HC4 | A | 2PYP | 0.76 | ||
HC4 | A | 2ZOI | 0.76 | ||
HC4 | A | 1OTI | 0.76 | ||
HC4 | A | 1XFQ | 0.76 | ||
HC4 | A | 2D01 | 0.76 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7B | 0.76 | ||
HC4 | A | 2ZOH | 0.76 | ||
HC4 | A | 1GSW | 0.76 | ||
HC4 | A | 2QJ7 | 0.76 | ||
HC4 | A | 1F9I | 0.76 | ||
HC4 | X | 1UWP | 0.76 | ||
HC4 | A | 2PHY | 0.76 | ||
HC4 | A | 1T1B | 0.76 | ||
HC4 | A | 1F98 | 0.76 | ||
HC4 | A | 1T19 | 0.76 | ||
HC4 | X | 1UWN | 0.76 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7F | 0.76 | ||
HC4 | A | 1UGU | 0.76 | ||
HC4 | A | 1TS8 | 0.76 | ||
HC4 | A,B | 1OTD | 0.76 | ||
HC4 | A | 1OTE | 0.76 | ||
HC4 | A | 1GSX | 0.76 | ||
HC4 | A | 1TS7 | 0.76 | ||
HC4 | A | 2PYR | 0.76 | ||
HC4 | A | 1S4S | 0.76 | ||
HC4 | A | 1GSV | 0.76 | ||
HC4 | A | 2I9V | 0.76 | ||
HC4 | A | 2QWS | 0.76 | ||
HC4 | A | 1XFN | 0.76 | ||
HC4 | A | 1S4R | 0.76 | ||
HC4 | A | 1T18 | 0.76 | ||
HC4 | A | 1OTA | 0.76 | ||
HC4 | A | 1D7E | 0.76 | ||
HC4 | A | 1S1Z | 0.76 | ||
HC4 | A,B,C | 1MZU | 0.76 | ||
HC4 | A,B | 1ODV | 0.76 | ||
HC4 | A,B | 2J3J | 0.76 | ||
HC4 | A | 2QJ5 | 0.76 | ||
HC4 | A | 1OTB | 0.76 | ||
HC4 | A | 2D02 | 0.76 | ||
HC4 | A | 1OT9 | 0.76 | ||
HC4 | A | 1NWZ | 0.76 | ||
HC4 | A | 1S1Y | 0.76 | ||
HHH | (2S)-hydroxy(4-hydroxyphenyl)ethanoic acid | A,B | 2R5V | 0.78 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.71 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG1 | 0.71 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RH0 | 0.71 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGU | 0.71 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.71 | |
RMN | (R)-MANDELIC ACID | A | 1MDL | 0.72 | |
RMN | (R)-MANDELIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1MCZ | 0.72 | |
DHR | (2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILE | A,B | 1E55 | 0.71 | |
CUS | (N-SALICYLIDEN-L-LEUCINATO)-COPPER(II) | A | 2EB9 | 0.7 | |
OMD | 2-(3,6-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1AJP | 0.71 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A | 2OPA | 0.74 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B,C | 1MFI | 0.74 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B | 1GYY | 0.74 | |
OHP | (2-HYDROXYPHENYL)ACETIC ACID | A | 2INZ | 0.75 | |
OX4 | 3-FLUORO-4-HYDROXYBENZALDEHYDE O- (CYCLOHEXYLCARBONYL)OXIME | A,B,C | 2OOW | 0.82 | |
OX3 | 4-HYDROXYBENZALDEHYDE O-(CYCLOHEXYLCARBONYL)OXIME | A,B,C | 2OOH | 0.84 | |
AEF | 4-(2-aminoethyl)phenol | A | 3BRA | 0.7 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.71 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.71 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 2AN4 | 0.71 | |
TOH | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IME | 0.8 | |
TOH | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IMD | 0.8 | |
3A3 | A | 2CGU | 0.72 | ||
HDI | 3-(4-HYDROXYPHENYL)-4,5-DIHYDRO- 5-ISOXAZOLE-ACETIC ACID METHYL ESTER | A,B,C | 1LJT | 0.77 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.71 | |
IM3 | (2E)-3-(3,4-DIHYDROXYPHENYL)-2- IMINOPROPANOIC ACID | A,B,C,D | 2E82 | 0.75 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | M,N,O,P,Q,R | 3PCN | 0.71 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | B | 1AI4 | 0.71 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D | 1Q0C | 0.71 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1F1V | 0.71 | |
ECO | ESTRADIOL-6 CARBOXYL-METHYL-OXIME | B,D,F,H | 1JNH | 0.75 |