Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02423989
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 |
PHL | L-PHENYLALANINOL | A,B | 1JOH | 0.71 | |
PHL | L-PHENYLALANINOL | I | 3APR | 0.71 | |
PHL | L-PHENYLALANINOL | A | 1DLZ | 0.71 | |
PHL | L-PHENYLALANINOL | A | 1IH9 | 0.71 | |
PHL | L-PHENYLALANINOL | A | 1OB4 | 0.71 | |
PHL | L-PHENYLALANINOL | I | 2ER6 | 0.71 | |
PHL | L-PHENYLALANINOL | A | 1R9U | 0.71 | |
PHL | L-PHENYLALANINOL | A | 1OB7 | 0.71 | |
PHL | L-PHENYLALANINOL | A,B | 1OB6 | 0.71 | |
PHL | L-PHENYLALANINOL | A,B,C | 1AMT | 0.71 | |
SS1 | 1-PHENYLETHANOL | H | 1UM5 | 0.77 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1I0D | 0.83 | |
PEL | 2-PHENYL-ETHANOL | D,H | 2I0T | 0.83 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1HZY | 0.83 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1I0B | 0.83 | |
PEL | 2-PHENYL-ETHANOL | A | 1EYW | 0.83 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1JGM | 0.83 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.7 | |
DES | DIETHYLSTILBESTROL | A,B | 3ERD | 0.7 | |
DES | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.7 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.7 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K5S | 0.75 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1KEC | 0.75 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K7D | 0.75 | |
791 | 2-PHENYLMALONIC ACID | A | 1O4P | 0.72 | |
IBP | IBUPROFEN | A | 3FKX | 0.75 | |
IBP | IBUPROFEN | A,B | 2BXG | 0.75 | |
IBP | IBUPROFEN | A,B | 1EQG | 0.75 | |
IBP | IBUPROFEN | A,B,C | 2WD9 | 0.75 | |
IBP | IBUPROFEN | A | 2PWS | 0.75 | |
PDH | (2S)-2-AMINO-3-PHENYL-1-PROPANOL | A | 1GQ0 | 0.71 | |
HCI | HYDROCINNAMIC ACID | A,B | 1BXG | 0.73 | |
HCI | HYDROCINNAMIC ACID | A,B | 1TOG | 0.73 | |
HCI | HYDROCINNAMIC ACID | A,B | 1V2F | 0.73 | |
HCI | HYDROCINNAMIC ACID | A,B | 1AHX | 0.73 | |
HCI | HYDROCINNAMIC ACID | A | 1TOI | 0.73 | |
HCI | HYDROCINNAMIC ACID | A,B | 1AY8 | 0.73 | |
HCI | HYDROCINNAMIC ACID | A | 1TOJ | 0.73 | |
I4B | ISOBUTYLBENZENE | A | 184L | 0.72 | |
EST | ESTRADIOL | A,B | 1GWR | 0.7 | |
EST | ESTRADIOL | A | 1FDS | 0.7 | |
EST | ESTRADIOL | A,B,C | 1G50 | 0.7 | |
EST | ESTRADIOL | A,B,C,D,E,F | 1ERE | 0.7 | |
EST | ESTRADIOL | A,B | 1A52 | 0.7 | |
EST | ESTRADIOL | A | 1FDT | 0.7 | |
EST | ESTRADIOL | A | 2OCF | 0.7 | |
EST | ESTRADIOL | A,B,C | 1QKU | 0.7 | |
EST | ESTRADIOL | A,B,C,D,L | 1E6W | 0.7 | |
EST | ESTRADIOL | A | 1IOL | 0.7 | |
EST | ESTRADIOL | H | 1JNN | 0.7 | |
EST | ESTRADIOL | B | 1QKT | 0.7 | |
EST | ESTRADIOL | A | 1FDW | 0.7 | |
EST | ESTRADIOL | A,B | 1AQU | 0.7 | |
EST | ESTRADIOL | A | 1LHU | 0.7 | |
EST | ESTRADIOL | A | 1A27 | 0.7 | |
EST | ESTRADIOL | L | 1JGL | 0.7 | |
EST | ESTRADIOL | A,B,E,F | 1PCG | 0.7 | |
EST | ESTRADIOL | A,B,C,D | 1FDU | 0.7 | |
EST | ESTRADIOL | A | 2J7X | 0.7 | |
EST | ESTRADIOL | A,B | 2D06 | 0.7 | |
BDB | A,B | 1KE3 | 0.73 | ||
BIP | 2-BENZYL-3-IODOPROPANOIC ACID | A,B,C,D | 1BAV | 0.73 | |
1OH | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.71 | |
12M | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.79 | |
458 | 4-[(1S,2S,5S)-5-(HYDROXYMETHYL)- 8-METHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL | A,B | 2B1V | 0.71 | |
BZS | L-BENZYLSUCCINIC ACID | A | 1CBX | 0.71 | |
BZS | L-BENZYLSUCCINIC ACID | A | 1HYT | 0.71 | |
BZS | L-BENZYLSUCCINIC ACID | A,B | 1WHT | 0.71 | |
2NA | naphthalen-2-ylmethanol | A,B,C | 3EE5 | 0.73 | |
CLT | 4-PHENYL-BUTANOIC ACID | A | 1THL | 0.72 | |
CLT | 4-PHENYL-BUTANOIC ACID | A,B | 2AY7 | 0.72 | |
CLT | 4-PHENYL-BUTANOIC ACID | E,I | 1TMN | 0.72 | |
DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B | 1QV7 | 0.71 | |
DFB | 2,3-DIFLUOROBENZYL ALCOHOL | A,B,C,D | 1MG0 | 0.71 | |
4FA | 4-FLUOROPHENETHYL ALCOHOL | A | 1OWZ | 0.8 | |
BTP | 2-THIOMETHYL-3-PHENYLPROPANOIC ACID | A,B | 1JAO | 0.7 | |
459 | 4-[(1S,2S,5S,9R)-5-(HYDROXYMETHYL)- 8,9-DIMETHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL | A,B | 2FAI | 0.7 | |
5PV | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.74 | |
B28 | A,B | 2E9A | 0.72 | ||
PPT | 3-(P-TOLYL)PROPIONIC ACID | A,B | 2AY4 | 0.74 | |
B08 | A,B | 2E99 | 0.73 | ||
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | A,B,I | 1ZSR | 0.71 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1ZJ7 | 0.71 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1ZLF | 0.71 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1HEG | 0.71 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1FQX | 0.71 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | A,B,I | 1IIQ | 0.71 | |
PS0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(S)- OL | I | 1HEF | 0.71 | |
PBA | PHENYLETHANE BORONIC ACID | C,G | 6CHA | 0.72 | |
IOB | 3-IODO-BENZYL ALCOHOL | A,B | 1QK0 | 0.72 | |
M5P | (S)-2-(MERCAPTOMETHYL)-5-PHENYLPENTANOIC ACID | A,B | 2YZ3 | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A | 1OS0 | 0.76 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJI | 0.76 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJJ | 0.76 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2VS2 | 0.76 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 1OD1 | 0.76 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | E | 1EPR | 0.76 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZK0 | 0.77 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJZ | 0.77 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJY | 0.77 | |
ARL | 7-(3,5-DITERT-BUTYLPHENYL)-3-METHYLOCTA- 2,4,6-TRIENOIC ACID | A | 1NQ7 | 0.73 | |
FLP | FLURBIPROFEN | A,B,C,D | 3PGH | 0.71 | |
FLP | FLURBIPROFEN | A,B | 1CQE | 0.71 | |
FLP | FLURBIPROFEN | A,B | 1EQH | 0.71 | |
FLP | FLURBIPROFEN | A,B | 2AYL | 0.71 | |
FLP | FLURBIPROFEN | A | 1DVT | 0.71 | |
FLP | FLURBIPROFEN | A | 1R9O | 0.71 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.73 | |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.72 | |
BPZ | 4,4'-cyclohexane-1,1-diyldiphenol | A | 2ZKC | 0.71 | |
R13 | 3-METHYL-7-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL) -OCTA-2,4,6-TRIENOIC ACID | A | 2CBS | 0.71 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZSF | 0.71 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A | 1JLD | 0.71 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B | 1IDA | 0.71 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B | 1IDB | 0.71 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1Z8C | 0.71 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZBG | 0.71 | |
PR0 | 3(S)-AMINO-4-PHENYL-BUTAN-2(R)- OL | A,B,I | 1ZPK | 0.71 | |
PAC | 2-PHENYLACETIC ACID | B | 1PNL | 0.7 | |
PAC | 2-PHENYLACETIC ACID | B | 1K5Q | 0.7 | |
PAC | 2-PHENYLACETIC ACID | B | 1FXH | 0.7 | |
PAC | 2-PHENYLACETIC ACID | A | 2ISF | 0.7 | |
PAC | 2-PHENYLACETIC ACID | A | 2INE | 0.7 | |
BFL | A,B | 1Q4G | 0.73 | ||
PPP | 3-PHENYL-1,2-PROPANDIOL | A,B | 1HRN | 0.8 | |
24B | (2,4-DIFLUOROPHENYL)METHANOL | A,B | 1QV6 | 0.71 | |
1PB | 1,4-DIPHENYL-2-BUTENE | A,B | 1OJ9 | 0.7 | |
2HR | HEXYLPHOSPHONIC ACID (R)-2-METHYL- 3-PHENYLPROPYL ESTER | X | 1YS1 | 0.8 | |
269 | (1R)-3-chloro-1-phenylpropan-1- ol | A | 2RBS | 0.7 | |
COR | 2,4-DIAMINO-1,5-DIPHENYL-3-HYDROXYPENTANE | A | 9HVP | 0.71 | |
TBC | (9S,10R)-9-HYDROXY-7,8,9,10-TETRAHYDROBENZO[A]PYRENE | A | 1N8C | 0.72 | |
2HS | HEXYLPHOSPHONIC ACID (S)-2-METHYL- 3-PHENYLPROPYL ESTER | X | 1YS2 | 0.8 | |
ELI | 6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID | A,B | 2GH5 | 0.7 | |
NDH | (1R, 2S)-CIS 1,2 DIHYDROXY-1,2- DIHYDRONAPHTHALENE | A,B | 1O7P | 0.76 | |
689 | 4-[(1S,2S,5S)-5-(HYDROXYMETHYL)- 6,8,9-TRIMETHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL | A,B | 1ZKY | 0.72 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.72 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.72 | |
KPV | 5-PHENYL-2-KETO-VALERIC ACID | A,B | 2Q5Q | 0.71 | |
PFL | 2,6-BIS(1-METHYLETHYL)PHENOL | A,B | 1E7A | 0.72 |