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)CCCN2CC3CCC(C2)N3C)N(C)C(=O)[C@@H](C)N(C)C1=O)C(C)C

InChI Key: InChIKey=FZMMXXNXMQUELQ-VOGCSRRBSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 286607   

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))	BDBM286607 (US9566312, Compound 2.19.3) 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)CCCN2CC3CCC(C2)N3C)N(C)C(=O)[C@@H](C)N(C)C1=O)C(C)C |r,TLB:73:74:81:77.78| Show InChI InChI=1S/C71H127N13O12/c1-26-28-30-46(14)60(85)59-64(89)74-52(27-2)67(92)76(18)49(17)66(91)82(24)58(45(13)31-29-34-84-38-50-32-33-51(39-84)77(50)19)63(88)75-56(43(9)10)70(95)78(20)53(35-40(3)4)62(87)72-47(15)61(86)73-48(16)65(90)79(21)54(36-41(5)6)68(93)80(22)55(37-42(7)8)69(94)81(23)57(44(11)12)71(96)83(59)25/h26,28,40-60,85H,27,29-39H2,1-25H3,(H,72,87)(H,73,86)(H,74,89)(H,75,88)/b28-26+/t45-,46-,47+,48-,49-,50?,51?,52+,53+,54+,55+,56+,57+,58+,59+,60-/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	0.800	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))	BDBM286607 (US9566312, Compound 2.19.3) 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)CCCN2CC3CCC(C2)N3C)N(C)C(=O)[C@@H](C)N(C)C1=O)C(C)C |r,TLB:73:74:81:77.78| Show InChI InChI=1S/C71H127N13O12/c1-26-28-30-46(14)60(85)59-64(89)74-52(27-2)67(92)76(18)49(17)66(91)82(24)58(45(13)31-29-34-84-38-50-32-33-51(39-84)77(50)19)63(88)75-56(43(9)10)70(95)78(20)53(35-40(3)4)62(87)72-47(15)61(86)73-48(16)65(90)79(21)54(36-41(5)6)68(93)80(22)55(37-42(7)8)69(94)81(23)57(44(11)12)71(96)83(59)25/h26,28,40-60,85H,27,29-39H2,1-25H3,(H,72,87)(H,73,86)(H,74,89)(H,75,88)/b28-26+/t45-,46-,47+,48-,49-,50?,51?,52+,53+,54+,55+,56+,57+,58+,59+,60-/m1/s1	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	0.300	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))	BDBM286607 (US9566312, Compound 2.19.3) 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)CCCN2CC3CCC(C2)N3C)N(C)C(=O)[C@@H](C)N(C)C1=O)C(C)C |r,TLB:73:74:81:77.78| Show InChI InChI=1S/C71H127N13O12/c1-26-28-30-46(14)60(85)59-64(89)74-52(27-2)67(92)76(18)49(17)66(91)82(24)58(45(13)31-29-34-84-38-50-32-33-51(39-84)77(50)19)63(88)75-56(43(9)10)70(95)78(20)53(35-40(3)4)62(87)72-47(15)61(86)73-48(16)65(90)79(21)54(36-41(5)6)68(93)80(22)55(37-42(7)8)69(94)81(23)57(44(11)12)71(96)83(59)25/h26,28,40-60,85H,27,29-39H2,1-25H3,(H,72,87)(H,73,86)(H,74,89)(H,75,88)/b28-26+/t45-,46-,47+,48-,49-,50?,51?,52+,53+,54+,55+,56+,57+,58+,59+,60-/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	0.400	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