Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00452907
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 |
BP4 | BIPHENYL-4-YL-ACETALDEHYDE | A,B,E,F,G,H | 1MHW | 0.71 | |
24I | (2S)-2-{[HYDROXY(4-IODOBENZYL)PHOSPHORYL]METHYL}PENTANEDIOIC ACID | A | 2C6C | 0.7 | |
KTP | (2-NAPHTHALEN-2-YL-1-NAPHTHALEN- 1-YL-2-OXO-ETHYL)-PHOSPHONIC ACID | A,B | 1KYN | 0.71 | |
DMW | 2,3-DIMETHYL-1,4-NAPHTHOQUINONE | A,B,C,D,E,F | 2BS4 | 0.78 | |
MQ8 | MENAQUINONE 8 | C,H,L,M | 1EYS | 0.73 | |
PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A,B | 2OK9 | 0.73 | |
PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A,B | 1Z76 | 0.73 | |
PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A | 1BK9 | 0.73 | |
HBX | benzaldehyde | A,B | 3GDN | 0.8 | |
1NH | (2E,6E)-8-[(3-BENZOYLBENZYL)OXY]- 3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE | B | 1O1S | 0.7 | |
HCI | HYDROCINNAMIC ACID | A,B | 1BXG | 0.7 | |
HCI | HYDROCINNAMIC ACID | A,B | 1TOG | 0.7 | |
HCI | HYDROCINNAMIC ACID | A,B | 1V2F | 0.7 | |
HCI | HYDROCINNAMIC ACID | A,B | 1AHX | 0.7 | |
HCI | HYDROCINNAMIC ACID | A | 1TOI | 0.7 | |
HCI | HYDROCINNAMIC ACID | A,B | 1AY8 | 0.7 | |
HCI | HYDROCINNAMIC ACID | A | 1TOJ | 0.7 | |
MQ9 | MENAQUINONE-9 | C,H,L,M | 3D38 | 0.73 | |
MQ9 | MENAQUINONE-9 | C,H,L,M | 1VRN | 0.73 | |
MQ9 | MENAQUINONE-9 | C,H,L,M | 2I5N | 0.73 | |
MQ9 | MENAQUINONE-9 | C,H,L,M,U | 1DXR | 0.73 | |
4MA | 4-METHYLBENZOIC ACID | A,H | 2HRG | 0.71 | |
CP5 | (2Z)-3-{[OXIDO(OXO)PHOSPHINO]OXY}- 2-PHENYLACRYLATE | A | 1SCW | 0.77 | |
LEG | 1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE | A,B | 2PIN | 0.8 | |
EBP | DIETHYL 4-METHYLBENZYLPHOSPHONATE | A,B | 1DPM | 0.78 | |
EBP | DIETHYL 4-METHYLBENZYLPHOSPHONATE | A,B | 1P6B | 0.78 | |
EBP | DIETHYL 4-METHYLBENZYLPHOSPHONATE | A,B | 1PSC | 0.78 | |
EBP | DIETHYL 4-METHYLBENZYLPHOSPHONATE | A,B | 3E3H | 0.78 | |
EBP | DIETHYL 4-METHYLBENZYLPHOSPHONATE | A,B | 1QW7 | 0.78 | |
EBP | DIETHYL 4-METHYLBENZYLPHOSPHONATE | A,B | 1P6C | 0.78 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 1PRC | 0.73 | |
MQ7 | MENAQUINONE-7 | A,B,D,M,N,P | 2B76 | 0.73 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 5PRC | 0.73 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 7PRC | 0.73 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 2PRC | 0.73 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 1R2C | 0.73 | |
MQ7 | MENAQUINONE-7 | A,B,C,E,F,G | 2VPW | 0.73 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 3PRC | 0.73 | |
MQ7 | MENAQUINONE-7 | A,B,D,M,N,O,P | 1L0V | 0.73 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 2JBL | 0.73 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 6PRC | 0.73 | |
9TA | 1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)- ETHYLAMINO]-ANTHRAQUINONE | A,B | 1FDG | 0.73 | |
2HR | HEXYLPHOSPHONIC ACID (R)-2-METHYL- 3-PHENYLPROPYL ESTER | X | 1YS1 | 0.71 | |
2HS | HEXYLPHOSPHONIC ACID (S)-2-METHYL- 3-PHENYLPROPYL ESTER | X | 1YS2 | 0.71 | |
787 | (PHENYL-PHOSPHONO-METHYL)-PHOSPHONIC ACID | A | 1O4R | 0.71 | |
VK3 | MENADIONE | A | 1TUV | 0.78 | |
VK3 | MENADIONE | A,B | 2QR2 | 0.78 | |
173 | BENZOYL-FORMIC ACID | A,B | 1SZE | 0.71 | |
HY1 | PHENYLACETALDEHYDE | D,H | 2I0S | 0.76 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6Y | 0.76 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6Z | 0.76 | |
HY1 | PHENYLACETALDEHYDE | D,H | 2OK4 | 0.76 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6U | 0.76 | |
3PL | 3-PHENYLPROPANAL | E | 1Y3G | 0.75 | |
1LP | TRANYLCYPROMINE | A,B | 1OJB | 0.74 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A | 1BE6 | 0.7 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A | 1BE8 | 0.7 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A,B,C,D,E,F, G,H | 2O78 | 0.7 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK1 | 0.83 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK4 | 0.83 | |
HPX | (2Z,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA- 2,4-DIENOIC ACID | A,B,C,D | 2DSA | 0.72 | |
BZQ | DIPHENYLMETHANONE | A,B | 1GT5 | 0.78 | |
BZQ | DIPHENYLMETHANONE | A,B | 1DZP | 0.78 | |
PQN | PHYLLOQUINONE | A,B,C,F,I,J, K,L,M,X | 1JB0 | 0.73 | |
PQN | PHYLLOQUINONE | 1,2,3,4,A,B, C,F,G,H,I,J, K,L | 2O01 | 0.73 | |
PQN | PHYLLOQUINONE | A,B,C,F,K,L | 2PPS | 0.73 | |
PQN | PHYLLOQUINONE | A,B,C,F,K,L | 1C51 | 0.73 | |
PQN | PHYLLOQUINONE | 0,1,2,3,4,5, 6,7,8,9,A,B, C,F,G,H,J,K, L,P,Q,R,U,V, W,Z | 1QZV | 0.73 | |
HPK | (3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATE | A | 2PUH | 0.78 | |
HPZ | (2E,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA- 2,4-DIENOIC ACID | A | 2PUJ | 0.72 |