Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02465351
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 |
1LP | TRANYLCYPROMINE | A,B | 1OJB | 0.81 | |
HPQ | HOMOPHENYLALANINYLMETHANE | B | 1EWP | 0.73 | |
KPV | 5-PHENYL-2-KETO-VALERIC ACID | A,B | 2Q5Q | 0.74 | |
4AF | 4-ACETYL-L-PHENYLALANINE | A | 1ZH6 | 0.7 | |
BFL | A,B | 1Q4G | 0.71 | ||
MQ9 | MENAQUINONE-9 | C,H,L,M | 3D38 | 0.86 | |
MQ9 | MENAQUINONE-9 | C,H,L,M | 1VRN | 0.86 | |
MQ9 | MENAQUINONE-9 | C,H,L,M | 2I5N | 0.86 | |
MQ9 | MENAQUINONE-9 | C,H,L,M,U | 1DXR | 0.86 | |
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 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K5S | 0.74 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1KEC | 0.74 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K7D | 0.74 | |
PQN | PHYLLOQUINONE | A,B,C,F,I,J, K,L,M,X | 1JB0 | 0.88 | |
PQN | PHYLLOQUINONE | 1,2,3,4,A,B, C,F,G,H,I,J, K,L | 2O01 | 0.88 | |
PQN | PHYLLOQUINONE | A,B,C,F,K,L | 2PPS | 0.88 | |
PQN | PHYLLOQUINONE | A,B,C,F,K,L | 1C51 | 0.88 | |
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 | 0.88 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 1PRC | 0.86 | |
MQ7 | MENAQUINONE-7 | A,B,D,M,N,P | 2B76 | 0.86 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 5PRC | 0.86 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 7PRC | 0.86 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 2PRC | 0.86 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 1R2C | 0.86 | |
MQ7 | MENAQUINONE-7 | A,B,C,E,F,G | 2VPW | 0.86 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 3PRC | 0.86 | |
MQ7 | MENAQUINONE-7 | A,B,D,M,N,O,P | 1L0V | 0.86 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 2JBL | 0.86 | |
MQ7 | MENAQUINONE-7 | C,H,L,M | 6PRC | 0.86 | |
BZQ | DIPHENYLMETHANONE | A,B | 1GT5 | 0.9 | |
BZQ | DIPHENYLMETHANONE | A,B | 1DZP | 0.9 | |
PBA | PHENYLETHANE BORONIC ACID | C,G | 6CHA | 0.71 | |
BEZ | BENZOIC ACID | A,B | 2F8D | 0.7 | |
BEZ | BENZOIC ACID | A,B | 1A8U | 0.7 | |
BEZ | BENZOIC ACID | A,B | 1REE | 0.7 | |
BEZ | BENZOIC ACID | A | 1L7Q | 0.7 | |
BEZ | BENZOIC ACID | A | 1I69 | 0.7 | |
BEZ | BENZOIC ACID | H,L | 1RUL | 0.7 | |
BEZ | BENZOIC ACID | A,B | 3CCF | 0.7 | |
BEZ | BENZOIC ACID | A | 1W9Q | 0.7 | |
BEZ | BENZOIC ACID | A,B,G,J | 2DU8 | 0.7 | |
BEZ | BENZOIC ACID | H,L | 1RUA | 0.7 | |
BEZ | BENZOIC ACID | A,B,C,D,E,F, G,H | 1H4O | 0.7 | |
BEZ | BENZOIC ACID | H,L | 1RU9 | 0.7 | |
BEZ | BENZOIC ACID | A,B,C,D | 2V32 | 0.7 | |
BEZ | BENZOIC ACID | A | 2QMQ | 0.7 | |
BEZ | BENZOIC ACID | A | 1UKB | 0.7 | |
BEZ | BENZOIC ACID | A,B | 1RED | 0.7 | |
BEZ | BENZOIC ACID | A,B | 1OC3 | 0.7 | |
BEZ | BENZOIC ACID | A,B | 1REF | 0.7 | |
BEZ | BENZOIC ACID | A,B | 2O02 | 0.7 | |
BEZ | BENZOIC ACID | A,B | 2VJ1 | 0.7 | |
BEZ | BENZOIC ACID | A,B,C | 1WSP | 0.7 | |
BEZ | BENZOIC ACID | A | 1HZ4 | 0.7 | |
BEZ | BENZOIC ACID | A | 2Q38 | 0.7 | |
BEZ | BENZOIC ACID | A,B,C,D | 1UUJ | 0.7 | |
BEZ | BENZOIC ACID | A,B | 2QL8 | 0.7 | |
BEZ | BENZOIC ACID | A | 2Q0I | 0.7 | |
BEZ | BENZOIC ACID | A,B | 1S8F | 0.7 | |
BEZ | BENZOIC ACID | D,E,F,G,H | 1DJR | 0.7 | |
BEZ | BENZOIC ACID | A,B,C,D,E,F, G,H,I | 1ONI | 0.7 | |
BEZ | BENZOIC ACID | A,B,C,D | 1I7Q | 0.7 | |
BEZ | BENZOIC ACID | A,B,C,D | 2RHM | 0.7 | |
BEZ | BENZOIC ACID | A,B | 2F78 | 0.7 | |
BEZ | BENZOIC ACID | A,B | 2VL2 | 0.7 | |
BEZ | BENZOIC ACID | A | 1HD2 | 0.7 | |
BEZ | BENZOIC ACID | A | 1JU4 | 0.7 | |
BEZ | BENZOIC ACID | H,L | 2AJY | 0.7 | |
BEZ | BENZOIC ACID | A,B,C | 3GV1 | 0.7 | |
BEZ | BENZOIC ACID | A | 2Q6U | 0.7 | |
BEZ | BENZOIC ACID | A,B | 1VE9 | 0.7 | |
BEZ | BENZOIC ACID | A,B | 1S9A | 0.7 | |
BEZ | BENZOIC ACID | H,L,M | 1OP3 | 0.7 | |
BEZ | BENZOIC ACID | A | 1W9E | 0.7 | |
BEZ | BENZOIC ACID | A,B,C,D | 2V2G | 0.7 | |
BEZ | BENZOIC ACID | H,L | 2AK1 | 0.7 | |
BEZ | BENZOIC ACID | A,B,C,D,E,F, G,H | 2V41 | 0.7 | |
BEZ | BENZOIC ACID | A,B | 1GYX | 0.7 | |
BEZ | BENZOIC ACID | A | 1V1T | 0.7 | |
BEZ | BENZOIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1YAJ | 0.7 | |
BEZ | BENZOIC ACID | A,B | 1HKQ | 0.7 | |
BEZ | BENZOIC ACID | H,L | 1RUK | 0.7 | |
BEZ | BENZOIC ACID | A | 2Q1B | 0.7 | |
BEZ | BENZOIC ACID | H,L | 1RUM | 0.7 | |
BEZ | BENZOIC ACID | A,B | 2F7A | 0.7 | |
BEZ | BENZOIC ACID | A,B,C,D,E,F, G,H | 1KIF | 0.7 | |
BEZ | BENZOIC ACID | A,B | 2V7B | 0.7 | |
BEZ | BENZOIC ACID | H | 1NCW | 0.7 | |
BEZ | BENZOIC ACID | A,B | 1TMX | 0.7 | |
BEZ | BENZOIC ACID | A | 1URM | 0.7 | |
BEZ | BENZOIC ACID | A | 1W9O | 0.7 | |
BEZ | BENZOIC ACID | A,B,C,D | 1GXS | 0.7 | |
BEZ | BENZOIC ACID | H | 1RUP | 0.7 | |
BEZ | BENZOIC ACID | A,B,C,D | 1KQB | 0.7 | |
BEZ | BENZOIC ACID | A | 2Q9R | 0.7 | |
BEZ | BENZOIC ACID | D,H | 2OK6 | 0.7 | |
BEZ | BENZOIC ACID | A,B | 2Q0J | 0.7 | |
PHM | PHENYLALANYLMETHANE | A,I | 1PJP | 0.71 | |
PHM | PHENYLALANYLMETHANE | A,B,C | 2J9J | 0.71 | |
PHM | PHENYLALANYLMETHANE | A,B,C | 2JE4 | 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 | |
HBC | (2-AMINO-3-PHENYL-BICYCLO[2.2.1]HEPT- 2-YL)-PHENYL-METHANONE | H | 1JGU | 0.74 | |
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 | |
9TA | 1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)- ETHYLAMINO]-ANTHRAQUINONE | A,B | 1FDG | 0.84 | |
BIP | 2-BENZYL-3-IODOPROPANOIC ACID | A,B,C,D | 1BAV | 0.72 | |
I4B | ISOBUTYLBENZENE | A | 184L | 0.74 | |
VK3 | MENADIONE | A | 1TUV | 0.87 | |
VK3 | MENADIONE | A,B | 2QR2 | 0.87 | |
PYL | PHENYLETHANE | C | 1B07 | 0.71 | |
PYL | PHENYLETHANE | A,B | 2VRM | 0.71 | |
PYL | PHENYLETHANE | A | 1NHB | 0.71 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A | 1BE6 | 0.71 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A | 1BE8 | 0.71 | |
TCA | PHENYLETHYLENECARBOXYLIC ACID | A,B,C,D,E,F, G,H | 2O78 | 0.71 | |
5PV | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.74 | |
C1E | (2Z,4E)-3-chloro-2-hydroxy-6-oxo- 6-phenylhexa-2,4-dienoic acid | A | 2RHT | 0.76 | |
N4B | N-BUTYLBENZENE | A | 186L | 0.71 | |
PPY | 3-PHENYLPYRUVIC ACID | A,B | 2Q5O | 0.74 | |
PPY | 3-PHENYLPYRUVIC ACID | A,B | 1LCO | 0.74 | |
PPY | 3-PHENYLPYRUVIC ACID | A,B,C,D,E,F | 2ZF4 | 0.74 | |
PPY | 3-PHENYLPYRUVIC ACID | A,B | 1BW9 | 0.74 | |
HGB | 4-(HYDROXYMERCURY)BENZOIC ACID | A | 1F2W | 0.7 | |
HGB | 4-(HYDROXYMERCURY)BENZOIC ACID | A | 2F14 | 0.7 | |
HGB | 4-(HYDROXYMERCURY)BENZOIC ACID | A | 1BV3 | 0.7 | |
HGB | 4-(HYDROXYMERCURY)BENZOIC ACID | A | 2AW1 | 0.7 | |
HGB | 4-(HYDROXYMERCURY)BENZOIC ACID | A | 1ZE8 | 0.7 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.71 | |
PPT | 3-(P-TOLYL)PROPIONIC ACID | A,B | 2AY4 | 0.74 | |
HBX | benzaldehyde | A,B | 3GDN | 0.81 | |
HCI | HYDROCINNAMIC ACID | A,B | 1BXG | 0.72 | |
HCI | HYDROCINNAMIC ACID | A,B | 1TOG | 0.72 | |
HCI | HYDROCINNAMIC ACID | A,B | 1V2F | 0.72 | |
HCI | HYDROCINNAMIC ACID | A,B | 1AHX | 0.72 | |
HCI | HYDROCINNAMIC ACID | A | 1TOI | 0.72 | |
HCI | HYDROCINNAMIC ACID | A,B | 1AY8 | 0.72 | |
HCI | HYDROCINNAMIC ACID | A | 1TOJ | 0.72 | |
MQ8 | MENAQUINONE 8 | C,H,L,M | 1EYS | 0.86 | |
173 | BENZOYL-FORMIC ACID | A,B | 1SZE | 0.77 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK1 | 0.93 | |
AC0 | 1-PHENYLETHANONE | A | 1ZK4 | 0.93 | |
ANQ | ACENAPHTHENEQUINONE | H,J | 1OAX | 0.78 | |
DMW | 2,3-DIMETHYL-1,4-NAPHTHOQUINONE | A,B,C,D,E,F | 2BS4 | 0.87 | |
MBO | MERCURIBENZOIC ACID | A | 2QO8 | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 1LUG | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 2HOC | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 3EFI | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 3BL0 | 0.7 | |
MBO | MERCURIBENZOIC ACID | A,B,C,D,E,F | 1NAQ | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 3CAJ | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 1DR7 | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 2HL4 | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 2GD8 | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 2QP6 | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 2HD6 | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 3C7P | 0.7 | |
MBO | MERCURIBENZOIC ACID | A,B | 2JHN | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 1DR6 | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 2HNC | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 2QOA | 0.7 | |
3PL | 3-PHENYLPROPANAL | E | 1Y3G | 0.78 | |
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 | |
LEG | 1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE | A,B | 2PIN | 0.95 | |
HPK | (3E)-2,6-DIOXO-6-PHENYLHEX-3-ENOATE | A | 2PUH | 0.85 | |
791 | 2-PHENYLMALONIC ACID | A | 1O4P | 0.71 | |
KTP | (2-NAPHTHALEN-2-YL-1-NAPHTHALEN- 1-YL-2-OXO-ETHYL)-PHOSPHONIC ACID | A,B | 1KYN | 0.72 | |
OSB | 2-SUCCINYLBENZOATE | A | 1FHV | 0.72 | |
OSB | 2-SUCCINYLBENZOATE | A,B,C,D | 1SJB | 0.72 | |
OSB | 2-SUCCINYLBENZOATE | A,B | 2QVH | 0.72 | |
HPZ | (2E,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA- 2,4-DIENOIC ACID | A | 2PUJ | 0.78 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.71 | |
AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.71 | |
BP4 | BIPHENYL-4-YL-ACETALDEHYDE | A,B,E,F,G,H | 1MHW | 0.75 | |
HPX | (2Z,4E)-2-HYDROXY-6-OXO-6-PHENYLHEXA- 2,4-DIENOIC ACID | A,B,C,D | 2DSA | 0.78 | |
BHO | BENZHYDROXAMIC ACID | A,B | 1GX2 | 0.71 | |
BHO | BENZHYDROXAMIC ACID | A | 1HSR | 0.71 | |
BHO | BENZHYDROXAMIC ACID | A,B | 2ATJ | 0.71 | |
BHO | BENZHYDROXAMIC ACID | A,B | 4ATJ | 0.71 | |
BHO | BENZHYDROXAMIC ACID | A,B | 3ATJ | 0.71 | |
BHO | BENZHYDROXAMIC ACID | A | 3GCK | 0.71 | |
BHO | BENZHYDROXAMIC ACID | A,B,C,D,E,F, G,H | 2BOY | 0.71 | |
FPR | PROPYLBENZENE | C | 1RHK | 0.71 | |
TRZ | TRAZEOLIDE | A | 1C12 | 0.73 | |
ELI | 6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID | A,B | 2GH5 | 0.77 | |
C0E | 3-fluoro-6-(4-fluorophenyl)-2-hydroxy- 6-oxohexa-2,4-dienoic acid | A | 2RHW | 0.75 | |
4MA | 4-METHYLBENZOIC ACID | A,H | 2HRG | 0.72 | |
PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A,B | 2OK9 | 0.81 | |
PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A,B | 1Z76 | 0.81 | |
PBP | 1-(4-BROMO-PHENYL)-ETHANONE | A | 1BK9 | 0.81 | |
HY1 | PHENYLACETALDEHYDE | D,H | 2I0S | 0.79 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6Y | 0.79 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6Z | 0.79 | |
HY1 | PHENYLACETALDEHYDE | D,H | 2OK4 | 0.79 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6U | 0.79 | |
CIN | 4-CARBOXYCINNAMIC ACID | A,B,C,D | 1HAB | 0.7 | |
CIN | 4-CARBOXYCINNAMIC ACID | A,B | 1T6J | 0.7 | |
PAC | 2-PHENYLACETIC ACID | B | 1PNL | 0.72 | |
PAC | 2-PHENYLACETIC ACID | B | 1K5Q | 0.72 | |
PAC | 2-PHENYLACETIC ACID | B | 1FXH | 0.72 | |
PAC | 2-PHENYLACETIC ACID | A | 2ISF | 0.72 | |
PAC | 2-PHENYLACETIC ACID | A | 2INE | 0.72 |