Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02675353
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 |
2MP | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.72 |  |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.71 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBC | 0.73 | |
| BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBF | 0.73 | |
| BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1SXK | 0.73 | |
247 | (3R)-3-amino-2,2-difluoro-3-(4- hydroxyphenyl)propanoic acid | A,B | 2QVE | 0.71 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.71 | |
4HL | 4-(HYDRAZINOMETHYL)PHENOL | A,B | 2E2U | 0.73 | |
ANX | 2,5-DINITROPHENOL | A,B,C,D,E,F, G,H | 2BFG | 0.71 | |
A48 | 4-[(DIMESITYLBORYL)(2,2,2-TRIFLUOROETHYL)AMINO]PHENOL | A,B | 2Q6J | 0.72 | |
NCR | 2-NITRO-P-CRESOL | A,B | 1AHV | 0.76 | |
D4P | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A | 1DSR | 0.71 | |
| D4P | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.71 | |
| D4P | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.71 | |
MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | A,B,C,D,I,J, K,L | 3EWF | 0.73 | |
| MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | A,B,I,L | 2V5W | 0.73 | |
| MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | B | 1VDN | 0.73 | |
| MCM | 7-AMINO-4-METHYL-CHROMEN-2-ONE | C | 1VAI | 0.73 | |
TY2 | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.75 | |
LDP | L-DOPAMINE | A,B | 2A3R | 0.73 | |
| LDP | L-DOPAMINE | A | 5PAH | 0.73 | |
| LDP | L-DOPAMINE | A,B | 2QMZ | 0.73 | |
| LDP | L-DOPAMINE | A,B | 2VQ5 | 0.73 | |
HAB | A,B | 1SRE | 0.7 | | |
SGI | 3-(4-hydroxyphenyl)propanamide | A,B | 2R9K | 0.71 | |
IPB | 5-METHYL-2-(1-METHYLETHYL)PHENOL | A,B | 1E06 | 0.72 | |
RHP | (3R)-3-(PROP-2-YNYLAMINO)INDAN- 5-OL | A,B | 1S3E | 0.71 | |
SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.73 | |
| SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.73 | |
FEN | N-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDE | A | 1FEL | 0.74 | |
2AC | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.85 | |
| 2AC | 2-AMINO-P-CRESOL | A | 1L4M | 0.85 | |
44B | 1,1,1,3,3,3-HEXAFLUORO-2-{4-[(2,2,2- TRIFLUOROETHYL)AMINO]PHENYL}PROPAN- 2-OL | A,B,C,D | 1PQ9 | 0.72 | |
AZY | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.74 | |
DMC | 3-(4-DIETHYLAMINO-2-HYDROXY-PHENYL)- 2-METHYL-PROPIONIC ACID | G | 4GCH | 0.74 | |
BC6 | (4E,8S,9R,10E,12S,13R,14S,16R)- 13,20-dihydroxy-14-methoxy-4,8,10,12,16- pentamethyl-3-oxo-2-azabicyclo[16.3.1]docosa- 1(22),4,10,18,20-pentaen-9-yl carbamate | A,B,C,D | 2VW5 | 0.71 | |
4NC | 4-NITROCATECHOL | A | 1NO3 | 0.71 | |
| 4NC | 4-NITROCATECHOL | B | 2BUU | 0.71 | |
| 4NC | 4-NITROCATECHOL | B | 2BUZ | 0.71 | |
| 4NC | 4-NITROCATECHOL | B | 1EOC | 0.71 | |
AHT | 4-(2,5-DIAMINO-5-HYDROXY-PENTYL)- PHENOL | I,T | 1TMB | 0.72 | |
DNT | 2-[1-METHYLHEXYL]-4,6-DINITROPHENOL | A,B,C | 1NEN | 0.72 | |
2AF | 2-AMINOPHENOL | A | 1L4N | 0.78 | |
DGH | (2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.71 | |
| DGH | (2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.71 | |
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 | |
EDR | EDROPHONIUM ION | A | 1AX9 | 0.76 | |
| EDR | EDROPHONIUM ION | A | 2ACK | 0.76 | |
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 | |
NPO | P-NITROPHENOL | A,B | 1Z44 | 0.71 | |
| NPO | P-NITROPHENOL | X | 2ZYW | 0.71 | |
| NPO | P-NITROPHENOL | H,L | 1YEK | 0.71 | |
| NPO | P-NITROPHENOL | A,C,E,G | 43CA | 0.71 | |
| NPO | P-NITROPHENOL | A | 1LS6 | 0.71 | |
| NPO | P-NITROPHENOL | X | 2ZVP | 0.71 | |
| NPO | P-NITROPHENOL | A,B | 2I10 | 0.71 | |
| NPO | P-NITROPHENOL | A | 1VAH | 0.71 | |
| NPO | P-NITROPHENOL | A,B | 3ETT | 0.71 | |
| NPO | P-NITROPHENOL | A,B | 2D20 | 0.71 | |
| NPO | P-NITROPHENOL | X | 2ZYV | 0.71 | |
TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYM | 0.73 | |
| TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | B,C,D | 1TYL | 0.73 | |
| TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2OCU | 0.73 | |
| TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A,B,C,D,F | 3DJI | 0.73 | |
| TYL | N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL) | A | 2DPZ | 0.73 | |
4NL | 4-AMINOPHENOL | A | 2ORL | 0.79 | |
AEF | 4-(2-aminoethyl)phenol | A | 3BRA | 0.77 | |
GHP | 4-HYDROXYPHENYLGLYCINE | A | 1DSR | 0.71 | |
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 | |
AEH | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.76 | |
AED | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.75 | |
AEG | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.77 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.71 | |
4A3 | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.71 | |
SOA | ISATOIC ANHYDRIDE | A | 1BIO | 0.78 | |