BindingDB Reactant_set_id	Ligand SMILES	Ligand InChI	Ligand InChI Key	BindingDB MonomerID	BindingDB Ligand Name	Target Name	Target Source Organism According to Curator or DataSource	Ki (nM)	IC50 (nM)	Kd (nM)	EC50 (nM)	kon (M-1-s-1)	koff (s-1)	pH	Temp (C)	Curation/DataSource	Article DOI	BindingDB Entry DOI	PMID	PubChem AID	Patent Number	Authors	Institution	Link to Ligand in BindingDB	Link to Target in BindingDB	Link to Ligand-Target Pair in BindingDB	Ligand HET ID in PDB	PDB ID(s) for Ligand-Target Complex	PubChem CID of Ligand	PubChem SID of Ligand	ChEBI ID of Ligand	ChEMBL ID of Ligand	DrugBank ID of Ligand	IUPHAR_GRAC ID of Ligand	KEGG ID of Ligand	ZINC ID of Ligand	Number of Protein Chains in Target (>1 implies a multichain complex)	BindingDB Target Chain Sequence	PDB ID(s) of Target Chain	UniProt (SwissProt) Recommended Name of Target Chain	UniProt (SwissProt) Entry Name of Target Chain	UniProt (SwissProt) Primary ID of Target Chain	UniProt (SwissProt) Secondary ID(s) of Target Chain	UniProt (SwissProt) Alternative ID(s) of Target Chain	UniProt (TrEMBL) Submitted Name of Target Chain	UniProt (TrEMBL) Entry Name of Target Chain	UniProt (TrEMBL) Primary ID of Target Chain	UniProt (TrEMBL) Secondary ID(s) of Target Chain	UniProt (TrEMBL) Alternative ID(s) of Target Chain
50497955	CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccccc1)C(O)=O	InChI=1S/C191H302N50O62S3/c1-18-98(13)153(239-180(292)129(77-96(9)10)229-184(296)137(89-244)236-178(290)132(82-104-85-203-92-207-104)233-188(300)154(99(14)19-2)240-181(293)130(78-97(11)12)230-185(297)138(90-245)237-189(301)155(100(15)246)241-156(268)107(195)79-102-40-42-105(247)43-41-102)187(299)225-123(54-65-152(266)267)168(280)218-122(53-64-151(264)265)172(284)235-136(88-243)183(295)222-116(47-58-143(199)251)169(281)232-133(83-144(200)252)179(291)220-115(46-57-142(198)250)164(276)214-114(45-56-141(197)249)163(275)217-118(49-60-147(256)257)165(277)209-109(36-25-28-68-192)158(270)213-113(44-55-140(196)248)162(274)216-117(48-59-146(254)255)166(278)210-110(37-26-29-69-193)159(271)215-120(51-62-149(260)261)170(282)227-128(76-95(7)8)177(289)223-124(66-72-305-16)173(285)219-121(52-63-150(262)263)171(283)226-127(75-94(5)6)176(288)221-119(50-61-148(258)259)167(279)211-112(39-31-71-204-191(201)202)160(272)231-131(81-103-84-205-108-35-24-23-34-106(103)108)157(269)206-86-145(253)208-135(87-242)182(294)224-125(67-73-306-17)174(286)228-126(74-93(3)4)175(287)212-111(38-27-30-70-194)161(273)238-139(91-304)186(298)234-134(190(302)303)80-101-32-21-20-22-33-101/h20-24,32-35,40-43,84-85,92-100,107,109-139,153-155,205,242-247,304H,18-19,25-31,36-39,44-83,86-91,192-195H2,1-17H3,(H2,196,248)(H2,197,249)(H2,198,250)(H2,199,251)(H2,200,252)(H,203,207)(H,206,269)(H,208,253)(H,209,277)(H,210,278)(H,211,279)(H,212,287)(H,213,270)(H,214,276)(H,215,271)(H,216,274)(H,217,275)(H,218,280)(H,219,285)(H,220,291)(H,221,288)(H,222,295)(H,223,289)(H,224,294)(H,225,299)(H,226,283)(H,227,282)(H,228,286)(H,229,296)(H,230,297)(H,231,272)(H,232,281)(H,233,300)(H,234,298)(H,235,284)(H,236,290)(H,237,301)(H,238,273)(H,239,292)(H,240,293)(H,241,268)(H,254,255)(H,256,257)(H,258,259)(H,260,261)(H,262,263)(H,264,265)(H,266,267)(H,302,303)(H4,201,202,204)/t98-,99-,100+,107-,109-,110-,111-,112-,113-,114-,115-,116-,117-,118-,119-,120-,121-,122-,123-,124-,125-,126-,127-,128-,129-,130-,131-,132-,133-,134-,135-,136-,137-,138-,139-,153-,154-,155-/m0/s1	AKFPNHBCTQHOOY-GWLVHCPYSA-N	50172458	CHEMBL3809899	Caveolin-1				>155						ChEMBL	10.1021/acs.jmedchem.5b01536	10.7270/Q2V69MH1	27010220			Gilliam, AJ; Smith, JN; Flather, D; Johnston, KM; Gansmiller, AM; Fishman, DA; Edgar, JM; Balk, M; Majumdar, S; Weiss, GA	University of California Irvine	http://www.bindingdb.org/bind/chemsearch/marvin/MolStructure.jsp?monomerid=50172458	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=pol&polymerid=50007105&target=Caveolin-1&column=ki&startPg=0&Increment=50&submit=Search	http://www.bindingdb.org/jsp/dbsearch/PrimarySearch_ki.jsp?energyterm=kJ/mole&tag=r21&monomerid=50172458&enzyme=Caveolin-1&column=ki&startPg=0&Increment=50&submit=Search			127045489	346548697		CHEMBL3809899			C02248		1	MSGGKYVDSEGHLYTVPIREQGNIYKPNNKAMADELSEKQVYDAHTKEIDLVNRDPKHLNDDVVKIDFEDVIAEPEGTHSFDGIWKASFTTFTVTKYWFYRLLSALFGIPMALIWGIYFAILSFLHIWAVVPCIKSFLIEIQCISRVYSIYVHTVCDPLFEAVGKIFSNVRINLQKEI	7SC0	Caveolin-1	CAV1_HUMAN	Q03135	Q9UGP1 Q9UNG1 Q9UQH6