Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03674717
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 |
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 | |
247 | (3R)-3-amino-2,2-difluoro-3-(4- hydroxyphenyl)propanoic acid | A,B | 2QVE | 0.71 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.74 | |
| OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.74 | |
| OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 2AN4 | 0.74 | |
PET | 1,5-DI(4-AMIDINOPHENOXY)-3-OXA- PENTANE | B | 166D | 0.72 | |
OX3 | 4-HYDROXYBENZALDEHYDE O-(CYCLOHEXYLCARBONYL)OXIME | A,B,C | 2OOH | 0.71 | |
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.72 | |
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 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.74 | |
| OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG1 | 0.74 | |
| OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RH0 | 0.74 | |
| OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGU | 0.74 | |
| OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.74 | |
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 | 0.72 | |
CRS | M-CRESOL | A,B,C,D | 1EV3 | 0.72 | |
| CRS | M-CRESOL | A,B,C,D,E,F | 2OMG | 0.72 | |
| CRS | M-CRESOL | A,B | 1UZ9 | 0.72 | |
| CRS | M-CRESOL | A,B,C,D | 1ZEH | 0.72 | |
| CRS | M-CRESOL | A,B,C,D,E,F | 1ZEI | 0.72 | |
| CRS | M-CRESOL | A,C,D,E | 7INS | 0.72 | |
| CRS | M-CRESOL | A,B,C,D,E,G, I,K | 1EV6 | 0.72 | |
AEG | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.76 | |
OX5 | 4-HYDROXYBENZALDEHYDE O-(3,3-DIMETHYLBUTANOYL)OXIME | A,B,C | 2OOZ | 0.72 | |
IPB | 5-METHYL-2-(1-METHYLETHYL)PHENOL | A,B | 1E06 | 0.7 | |
AEH | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.77 | |
LDP | L-DOPAMINE | A,B | 2A3R | 0.74 | |
| LDP | L-DOPAMINE | A | 5PAH | 0.74 | |
| LDP | L-DOPAMINE | A,B | 2QMZ | 0.74 | |
| LDP | L-DOPAMINE | A,B | 2VQ5 | 0.74 | |
MBD | 3-METHYLCATECHOL | A | 1KNF | 0.72 | |
DID | 4,4'[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDE | A,B,C,D | 1RPW | 0.74 | |
TYC | L-TYROSINAMIDE | A | 2BF9 | 0.71 | |
| TYC | L-TYROSINAMIDE | A | 2OCI | 0.71 | |
4HL | 4-(HYDRAZINOMETHYL)PHENOL | A,B | 2E2U | 0.78 | |
2HC | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.71 | |
SBZ | [4-(1,3,2-DIOXABOROLAN-2-YLOXY)METHYL]BENZAMIDINE | A | 1S85 | 0.77 | |
TNT | 1,3-BIS(AMIDINOPHENOXY)PROPANE | B | 102D | 0.73 | |
| TNT | 1,3-BIS(AMIDINOPHENOXY)PROPANE | A | 1PRP | 0.73 | |
4BZ | 4-(HYDROXYMETHYL)BENZAMIDINE | A | 1S6H | 0.81 | |
2AC | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.73 | |
| 2AC | 2-AMINO-P-CRESOL | A | 1L4M | 0.73 | |
SCL | ACETIC ACID SALICYLOYL-AMINO-ESTER | A | 1EBV | 0.73 | |
HV7 | 1-METHYLAMINE-2-HYDROXY-4-METHOXY- BENZENE | C | 1A8G | 0.73 | |
108 | 2-(5-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)- PROPIONIC ACID | A | 1G3B | 0.76 | |
| 108 | 2-(5-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)- PROPIONIC ACID | A | 1G3D | 0.76 | |
PNT | 1,5-BIS(4-AMIDINOPHENOXY)PENTANE | X | 3CR4 | 0.72 | |
| PNT | 1,5-BIS(4-AMIDINOPHENOXY)PENTANE | B | 1D64 | 0.72 | |
| PNT | 1,5-BIS(4-AMIDINOPHENOXY)PENTANE | X | 3CR5 | 0.72 | |
| PNT | 1,5-BIS(4-AMIDINOPHENOXY)PENTANE | A,B,D,E | 1RKW | 0.72 | |
SGI | 3-(4-hydroxyphenyl)propanamide | A,B | 2R9K | 0.74 | |
55E | 4-(4-hydroxy-3-methylphenyl)-6- phenylpyrimidin-2(5H)-one | A | 3DCV | 0.73 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.75 | |
SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.74 | |
| SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.74 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.72 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E0Y | 0.7 | |
| FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E8G | 0.7 | |
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 | |
PFL | 2,6-BIS(1-METHYLETHYL)PHENOL | A,B | 1E7A | 0.7 | |
RM2 | 4-HYDROXY-N-PROPARGYL-1(R)-AMINOINDAN | A,B | 2C66 | 0.73 | |
109 | 2-(4-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)- PROPIONIC ACID | A | 1G3C | 0.76 | |
| 109 | 2-(4-CARBAMIMIDOYL-2-HYDROXY-BENZYLAMINO)- PROPIONIC ACID | A | 1G3E | 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 | |
AEF | 4-(2-aminoethyl)phenol | A | 3BRA | 0.77 | |
AED | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.74 | |
AHT | 4-(2,5-DIAMINO-5-HYDROXY-PENTYL)- PHENOL | I,T | 1TMB | 0.74 | |
GHP | 4-HYDROXYPHENYLGLYCINE | A | 1DSR | 0.71 | |
PCR | P-CRESOL | A | 1JHV | 0.73 | |
| PCR | P-CRESOL | A | 1JHU | 0.73 | |
| PCR | P-CRESOL | A,B,C,D | 1DIQ | 0.73 | |
HBD | 4-HYDROXYBENZAMIDE | B,C,D | 1BEN | 0.72 | |
SHA | SALICYLHYDROXAMIC ACID | X | 1V0H | 0.76 | |
| SHA | SALICYLHYDROXAMIC ACID | A | 2QPK | 0.76 | |
| SHA | SALICYLHYDROXAMIC ACID | A | 3FNL | 0.76 | |
| SHA | SALICYLHYDROXAMIC ACID | A | 3GCJ | 0.76 | |
| SHA | SALICYLHYDROXAMIC ACID | A | 1CK6 | 0.76 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.71 | |