Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03693304
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 |
DIB![]() | 3-AMINO-(DIMETHYLPROPYLAMINE) | A,D,E,G,I,J | 1S32 | 0.72 | ![]() |
DIB![]() | 3-AMINO-(DIMETHYLPROPYLAMINE) | E,I,J | 1M1A | 0.72 | ![]() |
DIB![]() | 3-AMINO-(DIMETHYLPROPYLAMINE) | D,I,J | 1M18 | 0.72 | ![]() |
DIB![]() | 3-AMINO-(DIMETHYLPROPYLAMINE) | E,I,J | 1M19 | 0.72 | ![]() |
IBN![]() | 2-METHYLPROPAN-1-AMINE | A,B | 2QDY | 0.86 | ![]() |
LEN![]() | 3-METHYLBUTAN-1-AMINE | A | 1PE5 | 0.86 | ![]() |
LEN![]() | 3-METHYLBUTAN-1-AMINE | A | 1PE7 | 0.86 | ![]() |
LEN![]() | 3-METHYLBUTAN-1-AMINE | A | 1PE8 | 0.86 | ![]() |
DCI![]() | 2-METHYL-BUTYLAMINE | E,I | 1ENT | 0.86 | ![]() |
DCI![]() | 2-METHYL-BUTYLAMINE | A,I | 1GVW | 0.86 | ![]() |
DCI![]() | 2-METHYL-BUTYLAMINE | E | 1EPP | 0.86 | ![]() |
DCI![]() | 2-METHYL-BUTYLAMINE | I | 4ER1 | 0.86 | ![]() |
A71![]() | (6-AMINOHEXYLAMINE)(TRIAMMINE) PLATINUM(II) COMPLEX | A,B | 2DYW | 0.72 | ![]() |
NEH![]() | ETHANAMINE | A | 1YY2 | 0.79 | ![]() |
NEH![]() | ETHANAMINE | A,B | 2IBI | 0.79 | ![]() |
B2I![]() | ISOLEUCINE BORONIC ACID | A,P | 1P04 | 0.76 | ![]() |
B2I![]() | ISOLEUCINE BORONIC ACID | E,I | 5EST | 0.76 | ![]() |
13D![]() | 1,3-DIAMINOPROPANE | A,B | 2F8W | 0.76 | ![]() |
1CB![]() | CYCLOPENTANAMINE | A | 2AS6 | 0.72 | ![]() |
N2P![]() | PENTANE-1,5-DIAMINE | A,B | 2OO0 | 0.82 | ![]() |
N2P![]() | PENTANE-1,5-DIAMINE | A,B | 1H3M | 0.82 | ![]() |
N2P![]() | PENTANE-1,5-DIAMINE | A,B,C,D | 1GZL | 0.82 | ![]() |
NPT![]() | NEOPENTYLAMINE | I | 1IVQ | 0.81 | ![]() |
B2V![]() | VALINE BORONIC ACID | A,P | 2LPR | 0.75 | ![]() |
B2V![]() | VALINE BORONIC ACID | A,P | 1P03 | 0.75 | ![]() |
B2V![]() | VALINE BORONIC ACID | A,P | 1P10 | 0.75 | ![]() |
B2V![]() | VALINE BORONIC ACID | A,B | 2H5D | 0.75 | ![]() |
B2V![]() | VALINE BORONIC ACID | A,P | 1P01 | 0.75 | ![]() |
BNO![]() | NORLEUCINE BORONIC ACID | A,P | 6LPR | 0.79 | ![]() |
BNO![]() | NORLEUCINE BORONIC ACID | A,P | 3LPR | 0.79 | ![]() |
BNO![]() | NORLEUCINE BORONIC ACID | A,P | 1P05 | 0.79 | ![]() |
B2A![]() | ALANINE BORONIC ACID | A | 2PWA | 0.73 | ![]() |
B2A![]() | ALANINE BORONIC ACID | A,P | 1GBF | 0.73 | ![]() |
B2A![]() | ALANINE BORONIC ACID | A,P | 1P02 | 0.73 | ![]() |
B2A![]() | ALANINE BORONIC ACID | A,P | 1GBB | 0.73 | ![]() |
B2A![]() | ALANINE BORONIC ACID | A,P | 1GBK | 0.73 | ![]() |
B2A![]() | ALANINE BORONIC ACID | A,P | 5LPR | 0.73 | ![]() |
CDE![]() | 1,2-DIMETHYL-PROPYLAMINE | C | 1B0R | 0.75 | ![]() |
BPT![]() | BIS(TRANS-PLATINUM ETHYLENEDIAMINE DIAMINE CHLORO)COMPLEX | A | 1AU6 | 0.75 | ![]() |
LYT![]() | BUTYLAMINE | A | 1EAG | 1 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A | 108M | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A,B | 1NBB | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A | 103M | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A,B | 2HBE | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A | 1GEJ | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A | 111M | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A | 1GEK | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A | 101M | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A | 104M | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A | 2MYC | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A | 1GEI | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A | 1GEM | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A | 105M | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A | 107M | 0.71 | ![]() |
NBN![]() | N-BUTYL ISOCYANIDE | A,B | 1S61 | 0.71 | ![]() |
ETN![]() | METHYLETHYLAMINE | A | 1TES | 0.73 | ![]() |
AML![]() | AMYLAMINE | A | 1JIR | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A | 1I7B | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B | 3DZ6 | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B,C,D | 1I7M | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A | 1I79 | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B | 2O06 | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B | 1JL0 | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A | 1I72 | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B,C,D | 1A99 | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B | 3DZ4 | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B | 3H0W | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B | 3DZ3 | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B | 1MSV | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A | 1I7C | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B | 3DZ7 | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B | 3EPB | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B,C,D | 1F3T | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B | 3DZ2 | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B | 3DZ5 | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B | 3EPA | 0.9 | ![]() |
PUT![]() | 1,4-DIAMINOBUTANE | A,B | 3H0V | 0.9 | ![]() |
BLE![]() | LEUCINE BORONIC ACID | A,P | 1GBL | 0.76 | ![]() |
BLE![]() | LEUCINE BORONIC ACID | A,P | 9LPR | 0.76 | ![]() |
BLE![]() | LEUCINE BORONIC ACID | A,P | 7LPR | 0.76 | ![]() |
BLE![]() | LEUCINE BORONIC ACID | A,P | 1GBC | 0.76 | ![]() |
BLE![]() | LEUCINE BORONIC ACID | A,P | 1GBH | 0.76 | ![]() |
3CN![]() | 3-AMINOPROPANE | A,B,C,D | 3C0R | 0.89 | ![]() |
3CN![]() | 3-AMINOPROPANE | B | 3BY4 | 0.89 | ![]() |
16D![]() | HEXANE-1,6-DIAMINE | A,B,C | 2QK9 | 0.75 | ![]() |
16D![]() | HEXANE-1,6-DIAMINE | A,B,C,D,E,F | 1WOG | 0.75 | ![]() |
A72![]() | TRANS-BIS(HEXYLAMINE)-(DIAMMINE) PLATINUM(II) COMPLEX | A,B | 2DYW | 0.7 | ![]() |
N3D![]() | N-methylpropane-1,3-diamine | A,B | 3EY2 | 0.72 | ![]() |