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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00711879

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MBC2-(5-{4-[AMINO(IMINO)METHYL]PHENYL}-
2-FURYL)-1H-BENZIMIDAZOLE-5-CARBOXIMIDAMIDE
A2I2I0.71
FIC5-fluoroindole-2-carboxylic acidA,B3DWS0.7
CBB1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE-
2-CARBOXYLIC ACID 3-CARBAMIMIDOYL-
BENZYLESTER
B1LPK0.71
PQQPYRROLOQUINOLINE QUINONEA,B1CQ10.74
PQQPYRROLOQUINOLINE QUINONEA,B1OTW0.74
PQQPYRROLOQUINOLINE QUINONEA,B1C9U0.74
PQQPYRROLOQUINOLINE QUINONEA,C1W6S0.74
PQQPYRROLOQUINOLINE QUINONEA,B1FLG0.74
PQQPYRROLOQUINOLINE QUINONEA1KV90.74
PQQPYRROLOQUINOLINE QUINONEA,C2AD60.74
PQQPYRROLOQUINOLINE QUINONEA,B1CRU0.74
PQQPYRROLOQUINOLINE QUINONEA,C1H4I0.74
PQQPYRROLOQUINOLINE QUINONEA,C2AD70.74
PQQPYRROLOQUINOLINE QUINONEA,C2AD80.74
PQQPYRROLOQUINOLINE QUINONEA,D,I2D0V0.74
PQQPYRROLOQUINOLINE QUINONEA,C4AAH0.74
PQQPYRROLOQUINOLINE QUINONEA,C,E,G1H4J0.74
PQQPYRROLOQUINOLINE QUINONEA1KB00.74
PQQPYRROLOQUINOLINE QUINONEA1YIQ0.74
PQQPYRROLOQUINOLINE QUINONEA,C1LRW0.74
PQQPYRROLOQUINOLINE QUINONEA,C1G720.74
ZAA(5-{3-[2-(5-methyl-2-phenyl-1,3-
oxazol-4-yl)ethoxy]benzyl}-2-phenyl-
2H-1,2,3-triazol-4-yl)acetic acid
A3BC50.73
DSI4-HYDROXY-6-(1H-INDOLE-2-CARBONYL)-
8-METHYL-3,6,7,8-TETRAHYDRO-3,6-
DIAZA-AS-INDACENE-2-CARBOXYLIC ACID METHYL ESTER
B1DSI0.71
6691-(5-CARBOXYPENTYL)-5-(2,6-DICHLOROBENZYLOXY)-
1H-INDOLE-2-CARBOXYLIC ACID
A1MZS0.72
IMM1-(4-IODOBENZOYL)-5-METHOXY-2-METHYL INDOLE-
3-ACETIC ACID
A,B1PGF0.73
IMM1-(4-IODOBENZOYL)-5-METHOXY-2-METHYL INDOLE-
3-ACETIC ACID
A,B1PGG0.73
3405-METHOXY-1,2-DIMETHYL-3-(PHENOXYMETHYL)INDOLE-
4,7-DIONE
A,B,C,D1KBO0.77
ET03-(5-methoxy-1H-indol-3-yl)propanoic acidA,B3ET00.7
IMNINDOMETHACINA2BXM0.7
IMNINDOMETHACINA3FO70.7
IMNINDOMETHACINA,B,C,D1Z9H0.7
IMNINDOMETHACINA2BXQ0.7
IMNINDOMETHACINA,B,C,D4COX0.7
IMNINDOMETHACINA2ALT0.7
IMNINDOMETHACINA2OTH0.7
IMNINDOMETHACINA,B2DM60.7
IMNINDOMETHACINA1S2A0.7
IMNINDOMETHACINA2ZB80.7
IMNINDOMETHACINA3HWZ0.7
IMNINDOMETHACINA2BXK0.7
DUO4-HYDROXY-2,8-DIMETHYL-1-OXO-6-
(4,5,6-TRIMETHOXY-1H-INDOLE-2-CARBONYL)-
1,2,3,6,7,8-HEXAHYDRO-3,6-DIAZA-
AS-INDACENE-2-CARBOXYLIC ACID METHYL ESTER
B107D0.71
240(2S)-2-(2-{[1-(4-METHOXYBENZOYL)-
2-METHYL-5-(TRIFLUOROMETHOXY)-1H-
INDOL-3-YL]METHYL}PHENOXY)PROPANOIC ACID
A,B2Q590.7
A535-{5-[(S)-2-AMINO-3-(1H-INDOL-3-
YL)-PROPOXYL]-PYRIDIN-3-YL}-3-[1-
(1H-PYRROL-2-YL)-METH-(Z)-YLIDENE]-
1,3-DIHYDRO-INDOL-2-ONE
A2GHG0.71
BPHBACTERIOPHEOPHYTIN AH,L,M1RG50.72
BPHBACTERIOPHEOPHYTIN AH,L,M2UWT0.72
BPHBACTERIOPHEOPHYTIN A1,2,3,5,6,7,
8,A,B,D,E,F,
G,H,I,J,K,L,
M,N,P,R,S,T,
U,V,W,Y
1PYH0.72
BPHBACTERIOPHEOPHYTIN AA,B,C1Z9K0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2UXK0.72
BPHBACTERIOPHEOPHYTIN AH,L,M1RY50.72
BPHBACTERIOPHEOPHYTIN AH,L,M1RZH0.72
BPHBACTERIOPHEOPHYTIN AC,H,L,M1EYS0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2UWS0.72
BPHBACTERIOPHEOPHYTIN AL,M4RCR0.72
BPHBACTERIOPHEOPHYTIN AH,L,M1K6N0.72
BPHBACTERIOPHEOPHYTIN AL,M1YF60.72
BPHBACTERIOPHEOPHYTIN AH,L,M2UX50.72
BPHBACTERIOPHEOPHYTIN AH,L,M3DTS0.72
BPHBACTERIOPHEOPHYTIN AC1E140.72
BPHBACTERIOPHEOPHYTIN AH,L,M3DTA0.72
BPHBACTERIOPHEOPHYTIN AL,M1PST0.72
BPHBACTERIOPHEOPHYTIN AL,M1KBY0.72
BPHBACTERIOPHEOPHYTIN AC,H,L,M1L9B0.72
BPHBACTERIOPHEOPHYTIN AL,M2RCR0.72
BPHBACTERIOPHEOPHYTIN AL,M1PCR0.72
BPHBACTERIOPHEOPHYTIN AL,M1M3X0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2HJ60.72
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DS80.72
BPHBACTERIOPHEOPHYTIN AH,L,M1FNQ0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2UXJ0.72
BPHBACTERIOPHEOPHYTIN AL,M1QOV0.72
BPHBACTERIOPHEOPHYTIN AH,L,M3DU30.72
BPHBACTERIOPHEOPHYTIN AH,L,M2UX40.72
BPHBACTERIOPHEOPHYTIN AL,M,R,S1AIJ0.72
BPHBACTERIOPHEOPHYTIN AL,M,N,O1AIG0.72
BPHBACTERIOPHEOPHYTIN AH,L,M1RGN0.72
BPHBACTERIOPHEOPHYTIN AL,M1JGX0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2UWV0.72
BPHBACTERIOPHEOPHYTIN AH,L,M1RQK0.72
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV60.72
BPHBACTERIOPHEOPHYTIN AH,L,M2UWW0.72
BPHBACTERIOPHEOPHYTIN AL,M,R,S1RZZ0.72
BPHBACTERIOPHEOPHYTIN AL,M,R,S1S000.72
BPHBACTERIOPHEOPHYTIN AH,L,M2HG30.72
BPHBACTERIOPHEOPHYTIN AH,L,M2UX30.72
BPHBACTERIOPHEOPHYTIN AL,M1OGV0.72
BPHBACTERIOPHEOPHYTIN AH,L,M3DUQ0.72
BPHBACTERIOPHEOPHYTIN AA,B1Z9J0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2GNU0.72
BPHBACTERIOPHEOPHYTIN AC1E6D0.72
BPHBACTERIOPHEOPHYTIN AL,M1MPS0.72
BPHBACTERIOPHEOPHYTIN AL,M,X2UXM0.72
BPHBACTERIOPHEOPHYTIN AH,L,M1RVJ0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2UXL0.72
BPHBACTERIOPHEOPHYTIN AC,D,L,M,R,S1L9J0.72
BPHBACTERIOPHEOPHYTIN AL,M2JJ00.72
BPHBACTERIOPHEOPHYTIN AL,M1JH00.72
BPHBACTERIOPHEOPHYTIN AH,L,M2GMR0.72
BPHBACTERIOPHEOPHYTIN AH,L,M3DU20.72
BPHBACTERIOPHEOPHYTIN AL,M1PSS0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2HG90.72
BPHBACTERIOPHEOPHYTIN AH,L,M2HIT0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2JIY0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2UWU0.72
BPHBACTERIOPHEOPHYTIN AL,M1JGZ0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2J8C0.72
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV30.72
BPHBACTERIOPHEOPHYTIN AH,L,M3DSY0.72
BPHBACTERIOPHEOPHYTIN AH,L,M1F6N0.72
BPHBACTERIOPHEOPHYTIN AH,L,M1FNP0.72
BPHBACTERIOPHEOPHYTIN AH,L,M1K6L0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2HHK0.72
BPHBACTERIOPHEOPHYTIN AL,M1JGW0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2J8D0.72
BPHBACTERIOPHEOPHYTIN AL,M1YST0.72
BPHBACTERIOPHEOPHYTIN AH,L,M3DTR0.72
BPHBACTERIOPHEOPHYTIN AL,M1JGY0.72
BPHBACTERIOPHEOPHYTIN AH,L,M2HH10.72
W032,6-DIMETHYL-1-(3-[3-METHYL-5-ISOXAZOLYL]-
PROPANYL)-4-[2-METHYL-4-ISOXAZOLYL]-
PHENOL
1,41QJY0.72
MR62-(3,5-DIMETHYLPHENYL)-1,3-BENZOXAZOLEA,B2QGE0.72
MMB(2R,3E)-2-{4-[(5-METHYL-2-PHENYL-
1,3-OXAZOL-4-YL)METHOXY]BENZYL}-
3-(PROPOXYIMINO)BUTANOIC ACID
A,C2NPA0.73
6IN4-(1-BENZYL-3-CARBAMOYLMETHYL-2-
METHYL-1H-INDOL-5-YLOXY)-BUTYRIC ACID
A1DB50.73
BPBBACTERIOPHEOPHYTIN BC,H,L,M3PRC0.72
BPBBACTERIOPHEOPHYTIN BC,H,L,M6PRC0.72
BPBBACTERIOPHEOPHYTIN BH,L,M1RY50.72
BPBBACTERIOPHEOPHYTIN BH,L,M1RZH0.72
BPBBACTERIOPHEOPHYTIN BL,M,R,S1RZZ0.72
BPBBACTERIOPHEOPHYTIN BL,M,R,S1S000.72
BPBBACTERIOPHEOPHYTIN BC,H,L,M2JBL0.72
BPBBACTERIOPHEOPHYTIN BC,H,L,M1VRN0.72
BPBBACTERIOPHEOPHYTIN BC,H,L,M7PRC0.72
BPBBACTERIOPHEOPHYTIN BC,H,L,M2PRC0.72
BPBBACTERIOPHEOPHYTIN BH,L,M1UMX0.72
BPBBACTERIOPHEOPHYTIN BC,H,L,M1R2C0.72
BPBBACTERIOPHEOPHYTIN BC,H,L,M3D380.72
BPBBACTERIOPHEOPHYTIN BC,H,L,M2I5N0.72
BPBBACTERIOPHEOPHYTIN BC,H,L,M5PRC0.72
BPBBACTERIOPHEOPHYTIN BC,H,L,M1PRC0.72
BPBBACTERIOPHEOPHYTIN BH,L,M1RVJ0.72
BPBBACTERIOPHEOPHYTIN BC,H,L,M,U1DXR0.72
BH1BACTERIOPHEOPHYTINH,L,M2BOZ0.73
BH1BACTERIOPHEOPHYTINA,B2BNS0.73
BH1BACTERIOPHEOPHYTINA,B2BNP0.73
5442-(1-METHYL-3-OXO-3-PHENYL-PROPYLAMINO)-
3-{4-[2-(5-METHYL-2-PHENYL-OXAZOL-
4-YL)-ETHOXY]-PHENYL}-PROPIONIC ACID
A,D1K740.74
5442-(1-METHYL-3-OXO-3-PHENYL-PROPYLAMINO)-
3-{4-[2-(5-METHYL-2-PHENYL-OXAZOL-
4-YL)-ETHOXY]-PHENYL}-PROPIONIC ACID
A,C,E,G1K7L0.74
JTPN-[(13-CYCLOHEXYL-6,7-DIHYDROINDOLO[1,2-
D][1,4]BENZOXAZEPIN-10-YL)CARBONYL]-
2-METHYL-L-ALANINE
A,B2DXS0.73
I3N1-BENZYL-5-METHOXY-2-METHYL-1H-
INDOL-3-YL)-ACETIC ACID
A1DCY0.7
GW4N-[(2S)-2-[(2-BENZOYLPHENYL)AMINO]-
3-{4-[2-(5-METHYL-2-PHENYL-1,3-
OXAZOL-4-YL)ETHOXY]PHENYL}PROPYL]ACETAMIDE
A,B2POB0.71
PHOPHEOPHYTIN AA,B,C,D,F,H,
K,L,T,V,Z
3A0H0.72
PHOPHEOPHYTIN AZ1W5C0.72
PHOPHEOPHYTIN AA,B,C,D,F,H,
I,K,L,M,T,V,X
2AXT0.72
PHOPHEOPHYTIN AA,B,C,D,E,H,
J,K,L,T,V,Z
3A0B0.72
PHOPHEOPHYTIN AA,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z
3BZ10.72
PHOPHEOPHYTIN A0,A,B,C,D,E,
G,J,K,L,M,N,
P,R,V,W
1IZL0.72
PHOPHEOPHYTIN AA,B,C,D,E,F,
J,K,V
1S5L0.72
PHOPHEOPHYTIN AA,B,C,D,F,G,
H,I,J,K,L,M,
O,P,Q,R
1ILX0.72
PHOPHEOPHYTIN AA,B,C,D,F,G,
H,I,J,K,L,M,
O,P,Q,R
1FE10.72
PHOPHEOPHYTIN AA,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z
3BZ20.72
8IN[3-(1-BENZYL-3-CARBAMOYLMETHYL-
2-METHYL-1H-INDOL-5-YLOXY)-PROPYL-
]-PHOSPHONIC ACID
A1DB40.7
TBV3-[2-[[3-(2-CARBOXYETHYL)-5-[[3-
ETHENYL-4-METHYL-5-[(2-METHYLPROPAN-
2-YL)OXY]-1H-PYRROL-2-YL]METHYL]-
4-METHYL-1H-PYRROL-2-YL]METHYL]-
5-[(Z)-(4-ETHENYL-3-METHYL-5-OXO-
PYRROL-2-YLIDENE)METHYL]-4-METHYL-
1H-PYRROL-3-YL]PROPANOIC ACID
A2WD40.72
241(2S)-2-(3-{[1-(4-METHOXYBENZOYL)-
2-METHYL-5-(TRIFLUOROMETHOXY)-1H-
INDOL-3-YL]METHYL}PHENOXY)PROPANOIC ACID
A,B2Q5P0.7
B3Cbenzyl [(1R)-1-({(2S,4R)-2-({(1S)-
5-amino-1-[(S)-1,3-benzoxazol-2-
yl(hydroxy)methyl]pentyl}carbamoyl)-
4-[(4-methylbenzyl)oxy]pyrrolidin-
1-yl}carbonyl)-3-phenylpropyl]carbamate
B3E0P0.7
4P54H-furo[3,2-b]pyrrole-5-carboxylic acidA,B,C,D3CUK0.75
9365-METHOXY-1,2-DIMETHYL-3-(4-NITROPHENOXYMETHYL)INDOLE-
4,7-DIONE
A,B,C,D1KBQ0.73
REW(2S,3S)-1-(4-METHOXYPHENYL)-3-(3-
(2-(5-METHYL-2-PHENYLOXAZOL-4-YL)ETHOXY)BENZYL)-
4-OXOAZETIDINE-2-CARBOXYLIC ACID
A2REW0.72
471N-((2S)-2-({(1Z)-1-METHYL-3-OXO-
3-[4-(TRIFLUOROMETHYL) PHENYL]PROP-
1-ENYL}AMINO)-3-{4-[2-(5-METHYL-
2-PHENYL-1,3-OXAZOL-4-YL)ETHOXY]PHENYL}PROPYL)PROPANAMIDE
A,B,C,D1KKQ0.7
5702-(2-BENZOYL-PHENYLAMINO)-3-{4-
[2-(5-METHYL-2-PHENYL-OXAZOL-4-
YL)-ETHOXY]-PHENYL}-PROPIONIC ACID
A,D1RDT0.74
5702-(2-BENZOYL-PHENYLAMINO)-3-{4-
[2-(5-METHYL-2-PHENYL-OXAZOL-4-
YL)-ETHOXY]-PHENYL}-PROPIONIC ACID
A,D1FM90.74
FLXN-[(FURAN-2-YL)CARBONYL]-(S)-LEUCYL-
(R)-[1-AMINO-2(1H-INDOL-3-YL)ETHYL]-
PHOSPHONIC ACID
A4AIG0.72
3CS3-[3-(3,3-DIMETHYLBUTANOYL)-1-(4-
IODOBENZYL)-5-(QUINOLIN-2-YLMETHOXY)-
1H-INDOL-2-YL]-2,2-DIMETHYLPROPANOIC ACID
A,B,C,D,E,F2Q7R0.72
D2GN-METHYL(5-(PYRIDIN-3-YL)FURAN-
2-YL)METHANAMINE
A,B,C,D2FDV0.7