null

SMILES: CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H]([C@H](C)COCCN2C[C@@H](C)OC[C@H]2C)N(C)C(=O)[C@@H](C)N(C)C1=O)C(C)C

InChI Key: InChIKey=OUOXRYSNDKBRQU-REOWVQJISA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 286565   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Peptidyl-prolyl cis-trans isomerase A (Homo sapiens (Human))	BDBM286565 (US9566312, Compound 2.8.4) Show SMILES CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H]([C@H](C)COCCN2C[C@@H](C)OC[C@H]2C)N(C)C(=O)[C@@H](C)N(C)C1=O)C(C)C |r| Show InChI InChI=1S/C70H126N12O14/c1-27-29-30-44(13)59(83)58-63(87)73-51(28-2)66(90)75(20)50(19)65(89)80(25)57(45(14)37-95-32-31-82-36-47(16)96-38-46(82)15)62(86)74-55(42(9)10)69(93)76(21)52(33-39(3)4)61(85)71-48(17)60(84)72-49(18)64(88)77(22)53(34-40(5)6)67(91)78(23)54(35-41(7)8)68(92)79(24)56(43(11)12)70(94)81(58)26/h27,29,39-59,83H,28,30-38H2,1-26H3,(H,71,85)(H,72,84)(H,73,87)(H,74,86)/b29-27+/t44-,45-,46-,47-,48+,49-,50-,51+,52+,53+,54+,55+,56+,57+,58+,59-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	0.900	n/a	n/a	n/a	7.4	n/a
Novartis AG US Patent					Assay Description Binding of inhibitors to expressed cyclophilins was determined using surface plasmon resonance (SPR) experiments. Briefly, avi-tagged cyclophilin pro...				US Patent US9566312 (2017) BindingDB Entry DOI: 10.7270/Q2K939J1
					More data for this Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase F, mitochondrial (Homo sapiens (Human))	BDBM286565 (US9566312, Compound 2.8.4) Show SMILES CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H]([C@H](C)COCCN2C[C@@H](C)OC[C@H]2C)N(C)C(=O)[C@@H](C)N(C)C1=O)C(C)C |r| Show InChI InChI=1S/C70H126N12O14/c1-27-29-30-44(13)59(83)58-63(87)73-51(28-2)66(90)75(20)50(19)65(89)80(25)57(45(14)37-95-32-31-82-36-47(16)96-38-46(82)15)62(86)74-55(42(9)10)69(93)76(21)52(33-39(3)4)61(85)71-48(17)60(84)72-49(18)64(88)77(22)53(34-40(5)6)67(91)78(23)54(35-41(7)8)68(92)79(24)56(43(11)12)70(94)81(58)26/h27,29,39-59,83H,28,30-38H2,1-26H3,(H,71,85)(H,72,84)(H,73,87)(H,74,86)/b29-27+/t44-,45-,46-,47-,48+,49-,50-,51+,52+,53+,54+,55+,56+,57+,58+,59-/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	0.700	n/a	n/a	n/a	7.4	n/a
Novartis AG US Patent					Assay Description Binding of inhibitors to expressed cyclophilins was determined using surface plasmon resonance (SPR) experiments. Briefly, avi-tagged cyclophilin pro...				US Patent US9566312 (2017) BindingDB Entry DOI: 10.7270/Q2K939J1
					More data for this Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase B (Homo sapiens (Human))	BDBM286565 (US9566312, Compound 2.8.4) Show SMILES CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H]([C@H](C)COCCN2C[C@@H](C)OC[C@H]2C)N(C)C(=O)[C@@H](C)N(C)C1=O)C(C)C |r| Show InChI InChI=1S/C70H126N12O14/c1-27-29-30-44(13)59(83)58-63(87)73-51(28-2)66(90)75(20)50(19)65(89)80(25)57(45(14)37-95-32-31-82-36-47(16)96-38-46(82)15)62(86)74-55(42(9)10)69(93)76(21)52(33-39(3)4)61(85)71-48(17)60(84)72-49(18)64(88)77(22)53(34-40(5)6)67(91)78(23)54(35-41(7)8)68(92)79(24)56(43(11)12)70(94)81(58)26/h27,29,39-59,83H,28,30-38H2,1-26H3,(H,71,85)(H,72,84)(H,73,87)(H,74,86)/b29-27+/t44-,45-,46-,47-,48+,49-,50-,51+,52+,53+,54+,55+,56+,57+,58+,59-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	0.700	n/a	n/a	n/a	7.4	n/a
Novartis AG US Patent					Assay Description Binding of inhibitors to expressed cyclophilins was determined using surface plasmon resonance (SPR) experiments. Briefly, avi-tagged cyclophilin pro...				US Patent US9566312 (2017) BindingDB Entry DOI: 10.7270/Q2K939J1
					More data for this Ligand-Target Pair