MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02243948

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
IBP	IBUPROFEN	A	3FKX	0.73
IBP	IBUPROFEN	A,B	2BXG	0.73
IBP	IBUPROFEN	A,B	1EQG	0.73
IBP	IBUPROFEN	A,B,C	2WD9	0.73
IBP	IBUPROFEN	A	2PWS	0.73
1PA	PHENYLMETHYLACETIC ACID ALANINE	I	1BHF	0.74
PFF	4-FLUORO-L-PHENYLALANINE	A	3F3C	0.71
PFF	4-FLUORO-L-PHENYLALANINE	A,C,E,F	2UUE	0.71
PFF	4-FLUORO-L-PHENYLALANINE	A	1ZNT	0.71
PFF	4-FLUORO-L-PHENYLALANINE	F,H	1OL1	0.71
PFF	4-FLUORO-L-PHENYLALANINE	A,C,F,H	2C5V	0.71
PFF	4-FLUORO-L-PHENYLALANINE	E,F	1OL2	0.71
HCI	HYDROCINNAMIC ACID	A,B	1BXG	0.73
HCI	HYDROCINNAMIC ACID	A,B	1TOG	0.73
HCI	HYDROCINNAMIC ACID	A,B	1V2F	0.73
HCI	HYDROCINNAMIC ACID	A,B	1AHX	0.73
HCI	HYDROCINNAMIC ACID	A	1TOI	0.73
HCI	HYDROCINNAMIC ACID	A,B	1AY8	0.73
HCI	HYDROCINNAMIC ACID	A	1TOJ	0.73
HMF	2-AMINO-4-PHENYL-BUTYRIC ACID	I,J	1AY6	0.73
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
5PV	5-PHENYLVALERIC ACID	A,B	2AY9	0.72
791	2-PHENYLMALONIC ACID	A	1O4P	0.7
HPE	HOMOPHENYLALANINE	A,B	1B1H	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	A	1OS0	0.72
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJI	0.72
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJJ	0.72
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2VS2	0.72
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	1OD1	0.72
DPH	DEAMINO-METHYL-PHENYLALANINE	E	1EPR	0.72
PPT	3-(P-TOLYL)PROPIONIC ACID	A,B	2AY4	0.72
3TY	3-[(3E)-3-(BENZYLHYDRAZONO)-4-HYDROXY- 6-OXOCYCLOHEXA-1,4-DIEN-1-YL]-L- ALANINE	A	1W5Z	0.7
PHI	IODO-PHENYLALANINE	A	1TF9	0.71
PHI	IODO-PHENYLALANINE	A,B,C,D	1ORW	0.71
PHI	IODO-PHENYLALANINE	A	1T6H	0.71
PHI	IODO-PHENYLALANINE	A,B,C	1NLU	0.71
PHI	IODO-PHENYLALANINE	A,I	1GA1	0.71
PHI	IODO-PHENYLALANINE	A,I	1GA4	0.71
PHI	IODO-PHENYLALANINE	P	1CZI	0.71
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
PG9	D-PHENYLGLYCINE	A,B,G,H	10GS	0.73
PG9	D-PHENYLGLYCINE	A,B,C,D	2B4K	0.73
4PH	4-methyl-L-phenylalanine	B,C	3BV9	0.73
APA	AMIDO PHENYL PYRUVIC ACID	H,I	1AHT	0.73
APA	AMIDO PHENYL PYRUVIC ACID	A,B,C,D	1A0L	0.73
APA	AMIDO PHENYL PYRUVIC ACID	A	1TPP	0.73
DPN	D-PHENYLALANINE	P	1MCS	0.73
DPN	D-PHENYLALANINE	A	1GOE	0.73
DPN	D-PHENYLALANINE	A	2RM9	0.73
DPN	D-PHENYLALANINE	A	1SOC	0.73
DPN	D-PHENYLALANINE	B,C,E,F	1SFQ	0.73
DPN	D-PHENYLALANINE	I	1ABJ	0.73
DPN	D-PHENYLALANINE	P	1DWE	0.73
DPN	D-PHENYLALANINE	I,M	1HLT	0.73
DPN	D-PHENYLALANINE	A,H,L	1J9C	0.73
DPN	D-PHENYLALANINE	I,T	1TMB	0.73
DPN	D-PHENYLALANINE	A	2JRY	0.73
DPN	D-PHENYLALANINE	A	2SOC	0.73
DPN	D-PHENYLALANINE	A	2YYF	0.73
DPN	D-PHENYLALANINE	I	2HGT	0.73
DPN	D-PHENYLALANINE	A,D	2Q3I	0.73
DPN	D-PHENYLALANINE	A,P	1MCD	0.73
DPN	D-PHENYLALANINE	P	1HAO	0.73
DPN	D-PHENYLALANINE	A,B,I	1Z8J	0.73
DPN	D-PHENYLALANINE	A,B,C	2PGQ	0.73
DPN	D-PHENYLALANINE	C,D,H,I,L,M, X,Y	1DVA	0.73
DPN	D-PHENYLALANINE	P	1NRR	0.73
DPN	D-PHENYLALANINE	I	1PPB	0.73
DPN	D-PHENYLALANINE	C,D,G,H	1NU7	0.73
DPN	D-PHENYLALANINE	I	2HPP	0.73
DPN	D-PHENYLALANINE	B,C	2OD3	0.73
DPN	D-PHENYLALANINE	A	1B0Q	0.73
DPN	D-PHENYLALANINE	B,C,E,F	1NU9	0.73
DPN	D-PHENYLALANINE	A,B,I	1Z8I	0.73
DPN	D-PHENYLALANINE	H,I,J	1TMU	0.73
DPN	D-PHENYLALANINE	A,B,C,D,E,F	2DNS	0.73
DPN	D-PHENYLALANINE	A	1GO9	0.73
DPN	D-PHENYLALANINE	B,C,E,F	1A0H	0.73
DPN	D-PHENYLALANINE	P	1MCF	0.73
DPN	D-PHENYLALANINE	A	2RME	0.73
DPN	D-PHENYLALANINE	H,I	1TMT	0.73
DPN	D-PHENYLALANINE	I	1ABI	0.73
DPN	D-PHENYLALANINE	R	1NRQ	0.73
DPN	D-PHENYLALANINE	B,C,F,G	2A1D	0.73
DPN	D-PHENYLALANINE	A,B	2Q33	0.73
DPN	D-PHENYLALANINE	C,H,L	1DAN	0.73
DPN	D-PHENYLALANINE	P	1MCE	0.73
DPN	D-PHENYLALANINE	B,C,E,F	2A45	0.73
DPN	D-PHENYLALANINE	A	2RMI	0.73
DPN	D-PHENYLALANINE	A,B,I	1TQ7	0.73
DPN	D-PHENYLALANINE	A	1W7M	0.73
DPN	D-PHENYLALANINE	P	1HAP	0.73
DPN	D-PHENYLALANINE	A,B	1ORF	0.73
DPN	D-PHENYLALANINE	I	1IHS	0.73
DPN	D-PHENYLALANINE	P	1MCC	0.73
DPN	D-PHENYLALANINE	A	2RMD	0.73
DPN	D-PHENYLALANINE	A	2JQB	0.73
DPN	D-PHENYLALANINE	I	2HPQ	0.73
DPN	D-PHENYLALANINE	C,E,F	1SHH	0.73
DPN	D-PHENYLALANINE	A,I	1CVR	0.73
DPN	D-PHENYLALANINE	L,P	1AUT	0.73
DPN	D-PHENYLALANINE	P	1MCI	0.73
DPN	D-PHENYLALANINE	H,I	3F6U	0.73
DPN	D-PHENYLALANINE	A	1BFW	0.73
DPN	D-PHENYLALANINE	H,I	1HAI	0.73
DPN	D-PHENYLALANINE	B,C	2THF	0.73
DPN	D-PHENYLALANINE	I	1IHT	0.73
DPN	D-PHENYLALANINE	A,P	1MCJ	0.73
DPN	D-PHENYLALANINE	A	1TKH	0.73
DPN	D-PHENYLALANINE	C,H,L,T	2FIR	0.73
DPN	D-PHENYLALANINE	A	2FMZ	0.73
DPN	D-PHENYLALANINE	A	1YL9	0.73
DPN	D-PHENYLALANINE	I	1HUT	0.73
DPN	D-PHENYLALANINE	I	1FXY	0.73
DPN	D-PHENYLALANINE	A	1YL8	0.73
DPN	D-PHENYLALANINE	C,H,L	1QFK	0.73
DPN	D-PHENYLALANINE	P	1MCB	0.73
DFA	DIPHENYLACETIC ACID	A,B,C	1GMY	0.71
APM	M-AMIDINOPHENYL-3-ALANINE	E	1PPH	0.73
ZAE	N-methyl-D-phenylalanine	H,I,R	1TBZ	0.7
PAC	2-PHENYLACETIC ACID	B	1PNL	0.75
PAC	2-PHENYLACETIC ACID	B	1K5Q	0.75
PAC	2-PHENYLACETIC ACID	B	1FXH	0.75
PAC	2-PHENYLACETIC ACID	A	2ISF	0.75
PAC	2-PHENYLACETIC ACID	A	2INE	0.75
MEA	N-METHYLPHENYLALANINE	A	2PIL	0.7
MEA	N-METHYLPHENYLALANINE	A,B,C,D	1H0I	0.7
MEA	N-METHYLPHENYLALANINE	A,B,I	1DOJ	0.7
PPY	3-PHENYLPYRUVIC ACID	A,B	2Q5O	0.71
PPY	3-PHENYLPYRUVIC ACID	A,B	1LCO	0.71
PPY	3-PHENYLPYRUVIC ACID	A,B,C,D,E,F	2ZF4	0.71
PPY	3-PHENYLPYRUVIC ACID	A,B	1BW9	0.71
BFL		A,B	1Q4G	0.72
IOY	P-IODO-D-PHENYLALANINE	A	1XBU	0.71
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A,B,M,N	1FJM	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1EVA	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1LCM	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A,B,C,D,E,F, G,H	2NYM	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	C,I	2IE3	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	C,F,X,Y	2NPP	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1EVC	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	C,F,G,H	3DW8	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A,B,C,D,E,F, G,H	2NYL	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1EVD	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1EVB	0.7
APD	3-METHYLPHENYLALANINE	A,B,C	1GMY	0.73
CXA	PHENYLALANINE-N-SULFONAMIDE	A	1IY7	0.71
APH	P-AMIDINOPHENYL-3-ALANINE	E,I	1PPC	0.73
APH	P-AMIDINOPHENYL-3-ALANINE	H	1ETS	0.73
APH	P-AMIDINOPHENYL-3-ALANINE	H	1ETT	0.73
APH	P-AMIDINOPHENYL-3-ALANINE	I	1QUR	0.73