null

SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](CS)C(O)=O

InChI Key: InChIKey=WYGBFIPJEFIRLV-KLMBZYLCSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50481212   

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
Neuronal acetylcholine receptor subunit alpha-3/beta-2 (Homo sapiens (Human))	BDBM50481212 (CHEMBL609593) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](CS)C(O)=O |r| Show InChI InChI=1S/C61H95N23O21S4/c1-5-26(2)47(59(102)82-40(23-109)61(104)105)83-53(96)32(11-29-16-66-24-69-29)76-50(93)31(8-9-42(63)86)75-52(95)34(14-44(65)88)77-51(94)33(13-43(64)87)73-46(90)18-68-48(91)27(3)71-55(98)38(21-107)80-49(92)28(4)72-58(101)41-7-6-10-84(41)60(103)35(12-30-17-67-25-70-30)78-54(97)36(19-85)79-57(100)39(22-108)81-56(99)37(20-106)74-45(89)15-62/h16-17,24-28,31-41,47,85,106-109H,5-15,18-23,62H2,1-4H3,(H2,63,86)(H2,64,87)(H2,65,88)(H,66,69)(H,67,70)(H,68,91)(H,71,98)(H,72,101)(H,73,90)(H,74,89)(H,75,95)(H,76,93)(H,77,94)(H,78,97)(H,79,100)(H,80,92)(H,81,99)(H,82,102)(H,83,96)(H,104,105)/t26-,27-,28-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,47-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Boise State University Curated by ChEMBL					Assay Description Inhibition of alpha3beta2 nAChR				Bioorg Med Chem 17: 5894-9 (2009) Article DOI: 10.1016/j.bmc.2009.07.005 BindingDB Entry DOI: 10.7270/Q2474DN8
					More data for this Ligand-Target Pair
Neuronal acetylcholine receptor subunit alpha-6/beta-2 (Homo sapiens (Human))	BDBM50481212 (CHEMBL609593) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CS)NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CS)NC(=O)[C@H](CS)NC(=O)CN)C(=O)N[C@@H](CS)C(O)=O |r| Show InChI InChI=1S/C61H95N23O21S4/c1-5-26(2)47(59(102)82-40(23-109)61(104)105)83-53(96)32(11-29-16-66-24-69-29)76-50(93)31(8-9-42(63)86)75-52(95)34(14-44(65)88)77-51(94)33(13-43(64)87)73-46(90)18-68-48(91)27(3)71-55(98)38(21-107)80-49(92)28(4)72-58(101)41-7-6-10-84(41)60(103)35(12-30-17-67-25-70-30)78-54(97)36(19-85)79-57(100)39(22-108)81-56(99)37(20-106)74-45(89)15-62/h16-17,24-28,31-41,47,85,106-109H,5-15,18-23,62H2,1-4H3,(H2,63,86)(H2,64,87)(H2,65,88)(H,66,69)(H,67,70)(H,68,91)(H,71,98)(H,72,101)(H,73,90)(H,74,89)(H,75,95)(H,76,93)(H,77,94)(H,78,97)(H,79,100)(H,80,92)(H,81,99)(H,82,102)(H,83,96)(H,104,105)/t26-,27-,28-,31-,32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,47-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Boise State University Curated by ChEMBL					Assay Description Inhibition of alpha6beta2 nAChR				Bioorg Med Chem 17: 5894-9 (2009) Article DOI: 10.1016/j.bmc.2009.07.005 BindingDB Entry DOI: 10.7270/Q2474DN8
					More data for this Ligand-Target Pair