BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 129 hits of ic50 for UniProtKB: P30559   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Oxytocin receptor


(Homo sapiens (Human))
BDBM50103475
PNG
(Pmp-Tyr-Ile-Thr-Asn-Cys-Pro-Orn-phe(I,N3)-NH2 | Pm...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)CC1(CCCCC1)SCCC(N)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CS)C(=O)N1CCCC1C(=O)NC(CCCN)C(=O)NC(Cc1ccc(N=[N+]=[N-])c(I)c1)C(N)=O
Show InChI InChI=1S/C57H84IN15O13S2/c1-5-31(2)47(69-52(81)40(26-33-13-16-35(86-4)17-14-33)64-46(77)29-57(20-7-6-8-21-57)88-24-19-44(60)75)54(83)70-48(32(3)74)55(84)67-41(28-45(61)76)51(80)68-42(30-87)56(85)73-23-10-12-43(73)53(82)65-38(11-9-22-59)50(79)66-39(49(62)78)27-34-15-18-37(71-72-63)36(58)25-34/h13-18,25,31-32,38-43,47-48,74,87H,5-12,19-24,26-30,59H2,1-4H3,(H2,60,75)(H2,61,76)(H2,62,78)(H,64,77)(H,65,82)(H,66,79)(H,67,84)(H,68,80)(H,69,81)(H,70,83)/t31-,32+,38?,39?,40-,41-,42-,43?,47-,48-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 0.320n/an/an/an/an/an/a



University of Montpellier

Curated by ChEMBL


Assay Description
Ability to inhibit OT-induced inositol phosphate accumulation was determined in CHO cells expressing the human OT receptor


J Med Chem 44: 3022-30 (2001)


Article DOI: 10.1021/jm010125u
BindingDB Entry DOI: 10.7270/Q29S1Q9F
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50100381
PNG
(5-Oxo-hexanoic acid {1-[((S)-1-carbamoyl-2-thiophe...)
Show SMILES CC(=O)CCCC(=O)NC1N=C(c2ccccc2)c2ccccc2N(CC(=O)N[C@@H](Cc2cccs2)C(N)=O)C1=O
Show InChI InChI=1S/C30H31N5O5S/c1-19(36)9-7-15-25(37)33-29-30(40)35(18-26(38)32-23(28(31)39)17-21-12-8-16-41-21)24-14-6-5-13-22(24)27(34-29)20-10-3-2-4-11-20/h2-6,8,10-14,16,23,29H,7,9,15,17-18H2,1H3,(H2,31,39)(H,32,38)(H,33,37)/t23-,29?/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration required for antagonist activity against oxytocin receptor


Bioorg Med Chem Lett 11: 1297-300 (2001)


Article DOI: 10.1016/s0960-894x(01)00201-3
BindingDB Entry DOI: 10.7270/Q2T72GQF
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50205990
PNG
(CHEMBL395429 | OXYTOCIN)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](N)CSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H66N12O12S2/c1-5-22(4)35-42(66)49-26(12-13-32(45)57)38(62)51-29(17-33(46)58)39(63)53-30(20-69-68-19-25(44)36(60)50-28(40(64)54-35)16-23-8-10-24(56)11-9-23)43(67)55-14-6-7-31(55)41(65)52-27(15-21(2)3)37(61)48-18-34(47)59/h8-11,21-22,25-31,35,56H,5-7,12-20,44H2,1-4H3,(H2,45,57)(H2,46,58)(H2,47,59)(H,48,61)(H,49,66)(H,50,60)(H,51,62)(H,52,65)(H,53,63)(H,54,64)/t22-,25-,26-,27-,28-,29-,30-,31-,35-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
Purchase

CHEBI
CHEMBL
KEGG
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.70n/an/an/an/an/an/a



University of Patras

Curated by ChEMBL


Assay Description
Displacement of [3H]OT from human OT receptor expressed in HEK cells


Eur J Med Chem 42: 799-806 (2007)


Article DOI: 10.1016/j.ejmech.2006.12.016
BindingDB Entry DOI: 10.7270/Q2P55N5J
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50190528
PNG
((2R)-2-(2,4-difluorophenyl)-2-[(3R,6R)-3-(2,3-dihy...)
Show SMILES CC(C)C[C@H]1N([C@@H](C(=O)N(C)C)c2ccc(F)cc2F)C(=O)[C@H](NC1=O)C1Cc2ccccc2C1
Show InChI InChI=1S/C27H31F2N3O3/c1-15(2)11-22-25(33)30-23(18-12-16-7-5-6-8-17(16)13-18)26(34)32(22)24(27(35)31(3)4)20-10-9-19(28)14-21(20)29/h5-10,14-15,18,22-24H,11-13H2,1-4H3,(H,30,33)/t22-,23-,24-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.70n/an/an/an/an/an/a



Cardiovascular and Urogenital Centre of Excellence for Drug Discovery

Curated by ChEMBL


Assay Description
Agonist activity at human OTR expressed in CHO cells assessed as inhibition of oxytocin-induced calcium mobilization by FLIPR assay


J Med Chem 49: 4159-70 (2006)


Article DOI: 10.1021/jm060073e
BindingDB Entry DOI: 10.7270/Q269735Q
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50100380
PNG
(5-Oxo-hexanoic acid (1-{[(S)-1-carbamoyl-2-(3,4-di...)
Show SMILES CC(=O)CCCC(=O)NC1N=C(c2ccccc2)c2ccccc2N(CC(=O)N[C@@H](Cc2ccc(Cl)c(Cl)c2)C(N)=O)C1=O
Show InChI InChI=1S/C32H31Cl2N5O5/c1-19(40)8-7-13-27(41)37-31-32(44)39(26-12-6-5-11-22(26)29(38-31)21-9-3-2-4-10-21)18-28(42)36-25(30(35)43)17-20-14-15-23(33)24(34)16-20/h2-6,9-12,14-16,25,31H,7-8,13,17-18H2,1H3,(H2,35,43)(H,36,42)(H,37,41)/t25-,31?/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory concentration required for antagonist activity against oxytocin receptor


Bioorg Med Chem Lett 11: 1297-300 (2001)


Article DOI: 10.1016/s0960-894x(01)00201-3
BindingDB Entry DOI: 10.7270/Q2T72GQF
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50410619
PNG
(CHEMBL2113208)
Show SMILES COCCOCCOc1ccc(cc1)S(=O)(=O)N(CC(=O)N\N=C1/C(=O)Nc2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C27H27ClN4O7S/c1-37-14-15-38-16-17-39-21-10-12-22(13-11-21)40(35,36)32(20-8-6-19(28)7-9-20)18-25(33)30-31-26-23-4-2-3-5-24(23)29-27(26)34/h2-13H,14-18H2,1H3,(H,30,33)(H,29,31,34)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7n/an/an/an/an/an/a



Serono Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human Oxytocin induced intracellular Calcium mobilization in human Oxytocin receptor transfected HEK293-EBNA cells


J Med Chem 48: 7882-905 (2005)


Article DOI: 10.1021/jm050645f
BindingDB Entry DOI: 10.7270/Q2QF8TN3
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50205997
PNG
(CHEMBL395290 | [Pip7]OT)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](N)CSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1CCCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C44H68N12O12S2/c1-5-23(4)36-43(67)50-27(13-14-33(46)58)39(63)52-30(18-34(47)59)40(64)54-31(21-70-69-20-26(45)37(61)51-29(41(65)55-36)17-24-9-11-25(57)12-10-24)44(68)56-15-7-6-8-32(56)42(66)53-28(16-22(2)3)38(62)49-19-35(48)60/h9-12,22-23,26-32,36,57H,5-8,13-21,45H2,1-4H3,(H2,46,58)(H2,47,59)(H2,48,60)(H,49,62)(H,50,67)(H,51,61)(H,52,63)(H,53,66)(H,54,64)(H,55,65)/t23-,26-,27-,28-,29-,30-,31-,32-,36?/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7n/an/an/an/an/an/a



University of Patras

Curated by ChEMBL


Assay Description
Displacement of [3H]OT from human OT receptor expressed in HEK cells


Eur J Med Chem 42: 799-806 (2007)


Article DOI: 10.1016/j.ejmech.2006.12.016
BindingDB Entry DOI: 10.7270/Q2P55N5J
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50410616
PNG
(CHEMBL2113185)
Show SMILES Clc1ccc(cc1)N(CC(=O)N\N=C1/C(=O)Nc2ccccc12)S(=O)(=O)c1ccc(OCCN2CCOCC2)cc1
Show InChI InChI=1S/C28H28ClN5O6S/c29-20-5-7-21(8-6-20)34(19-26(35)31-32-27-24-3-1-2-4-25(24)30-28(27)36)41(37,38)23-11-9-22(10-12-23)40-18-15-33-13-16-39-17-14-33/h1-12H,13-19H2,(H,31,35)(H,30,32,36)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7n/an/an/an/an/an/a



Serono Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human Oxytocin induced intracellular Calcium mobilization in human Oxytocin receptor transfected HEK293-EBNA cells


J Med Chem 48: 7882-905 (2005)


Article DOI: 10.1021/jm050645f
BindingDB Entry DOI: 10.7270/Q2QF8TN3
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50410635
PNG
(CHEMBL2113211)
Show SMILES COCCOc1ccc(cc1)S(=O)(=O)N(CC(=O)N\N=C1/C(=O)Nc2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C25H23ClN4O6S/c1-35-14-15-36-19-10-12-20(13-11-19)37(33,34)30(18-8-6-17(26)7-9-18)16-23(31)28-29-24-21-4-2-3-5-22(21)27-25(24)32/h2-13H,14-16H2,1H3,(H,28,31)(H,27,29,32)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8n/an/an/an/an/an/a



Serono Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human Oxytocin induced intracellular Calcium mobilization in human Oxytocin receptor transfected HEK293-EBNA cells


J Med Chem 48: 7882-905 (2005)


Article DOI: 10.1021/jm050645f
BindingDB Entry DOI: 10.7270/Q2QF8TN3
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50027070
PNG
(CHEMBL2369136)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H](NC(=O)[C@H](N)C(C)(C)SSC[C@@H]2NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](CCC(=O)NCCCC[C@@H](NC(=O)[C@H]3CCCN3C2=O)C(=O)NCC(N)=O)NC1=O)[C@@H](C)c1c(C)cc(OC)cc1C
Show InChI InChI=1S/C49H76N12O12S2/c1-9-24(2)38-45(69)56-30-15-16-36(64)53-17-11-10-13-29(41(65)54-22-35(51)63)55-44(68)33-14-12-18-61(33)48(72)32(58-43(67)31(21-34(50)62)57-42(30)66)23-74-75-49(6,7)40(52)47(71)60-39(46(70)59-38)27(5)37-25(3)19-28(73-8)20-26(37)4/h19-20,24,27,29-33,38-40H,9-18,21-23,52H2,1-8H3,(H2,50,62)(H2,51,63)(H,53,64)(H,54,65)(H,55,68)(H,56,69)(H,57,66)(H,58,67)(H,59,70)(H,60,71)/t24-,27-,29+,30+,31+,32-,33+,38-,39-,40-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 8n/an/an/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
Binding affinity towards oxytocin receptor


J Med Chem 46: 4215-31 (2003)


Article DOI: 10.1021/jm0303103
BindingDB Entry DOI: 10.7270/Q2JW8FM1
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50384820
PNG
(EPELSIBAN | GSK557296B)
Show SMILES CC[C@H](C)[C@H]1N([C@@H](C(=O)N2CCOCC2)c2ccc(C)nc2C)C(=O)[C@H](NC1=O)C1Cc2ccccc2C1
Show InChI InChI=1S/C30H38N4O4/c1-5-18(2)26-28(35)32-25(23-16-21-8-6-7-9-22(21)17-23)29(36)34(26)27(24-11-10-19(3)31-20(24)4)30(37)33-12-14-38-15-13-33/h6-11,18,23,25-27H,5,12-17H2,1-4H3,(H,32,35)/t18-,25+,26+,27+/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
Purchase

PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 9.20n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50516419
PNG
(CHEMBL4464246)
Show SMILES CCOCc1nnc(N2C[C@@H]3C[C@@]3(C2)c2ccc(F)cc2Cl)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C22H23ClFN5O2/c1-3-31-12-19-26-27-21(29(19)16-5-7-20(30-2)25-10-16)28-11-14-9-22(14,13-28)17-6-4-15(24)8-18(17)23/h4-8,10,14H,3,9,11-13H2,1-2H3/t14-,22-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
PubMed
n/an/a 9.30n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50516428
PNG
(CHEMBL4449435)
Show SMILES COCc1nnc(N2CCC(CC2)c2ccc(F)cc2Cl)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H23ClFN5O2/c1-29-13-19-25-26-21(28(19)16-4-6-20(30-2)24-12-16)27-9-7-14(8-10-27)17-5-3-15(23)11-18(17)22/h3-6,11-12,14H,7-10,13H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
PubMed
n/an/a 10n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50410625
PNG
(CHEMBL2113201)
Show SMILES CN(C)CCCOc1ccc(cc1)S(=O)(=O)N(CC(=O)N\N=C1/C(=O)Nc2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C27H28ClN5O5S/c1-32(2)16-5-17-38-21-12-14-22(15-13-21)39(36,37)33(20-10-8-19(28)9-11-20)18-25(34)30-31-26-23-6-3-4-7-24(23)29-27(26)35/h3-4,6-15H,5,16-18H2,1-2H3,(H,30,34)(H,29,31,35)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 14n/an/an/an/an/an/a



Serono Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human Oxytocin induced intracellular Calcium mobilization in human Oxytocin receptor transfected HEK293-EBNA cells


J Med Chem 48: 7882-905 (2005)


Article DOI: 10.1021/jm050645f
BindingDB Entry DOI: 10.7270/Q2QF8TN3
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50326722
PNG
((Z)-3-(4-(N-(4-chlorophenyl)-N-(2-oxo-2-(2-(2-oxoi...)
Show SMILES CN(C)CCCNC(=O)CCc1ccc(cc1)S(=O)(=O)N(CC(=O)N\N=C1/C(=O)Nc2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C30H33ClN6O5S/c1-36(2)19-5-18-32-27(38)17-10-21-8-15-24(16-9-21)43(41,42)37(23-13-11-22(31)12-14-23)20-28(39)34-35-29-25-6-3-4-7-26(25)33-30(29)40/h3-4,6-9,11-16H,5,10,17-20H2,1-2H3,(H,32,38)(H,34,39)(H,33,35,40)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 14n/an/an/an/an/an/a



Serono Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human Oxytocin induced intracellular Calcium mobilization in human Oxytocin receptor transfected HEK293-EBNA cells


J Med Chem 48: 7882-905 (2005)


Article DOI: 10.1021/jm050645f
BindingDB Entry DOI: 10.7270/Q2QF8TN3
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50410634
PNG
(CHEMBL2113189)
Show SMILES CN(C)CCCOc1ccc(cc1)S(=O)(=O)N(CC(=O)N\N=C1/C(=O)NC(=O)c2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C28H28ClN5O6S/c1-33(2)16-5-17-40-21-12-14-22(15-13-21)41(38,39)34(20-10-8-19(29)9-11-20)18-25(35)31-32-26-23-6-3-4-7-24(23)27(36)30-28(26)37/h3-4,6-15H,5,16-18H2,1-2H3,(H,31,35)(H,30,36,37)/b32-26-
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 15n/an/an/an/an/an/a



Serono Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human Oxytocin induced intracellular Calcium mobilization in human Oxytocin receptor transfected HEK293-EBNA cells


J Med Chem 48: 7882-905 (2005)


Article DOI: 10.1021/jm050645f
BindingDB Entry DOI: 10.7270/Q2QF8TN3
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50516412
PNG
(CHEMBL4591825)
Show SMILES COCc1nnc(N2C[C@@H]3C[C@@]3(C2)c2ccc(F)cc2Cl)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H21ClFN5O2/c1-29-11-18-25-26-20(28(18)15-4-6-19(30-2)24-9-15)27-10-13-8-21(13,12-27)16-5-3-14(23)7-17(16)22/h3-7,9,13H,8,10-12H2,1-2H3/t13-,21-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
PubMed
n/an/a 15n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50305506
PNG
(5-(3-(3-(2-chloro-4-fluorophenoxy)azetidin-1-yl)-5...)
Show SMILES COCc1nnc(N2CC(C2)Oc2ccc(F)cc2Cl)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C19H19ClFN5O3/c1-27-11-17-23-24-19(26(17)13-4-6-18(28-2)22-8-13)25-9-14(10-25)29-16-5-3-12(21)7-15(16)20/h3-8,14H,9-11H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 23n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50516417
PNG
(CHEMBL4518063)
Show SMILES COCc1nnc(N2CC3CC3(C2)c2ccc(F)cc2Cl)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H21ClFN5O2/c1-29-11-18-25-26-20(28(18)15-4-6-19(30-2)24-9-15)27-10-13-8-21(13,12-27)16-5-3-14(23)7-17(16)22/h3-7,9,13H,8,10-12H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
PubMed
n/an/a 23n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50205999
PNG
(CHEMBL434193 | [Mpa1, D-Tyr(Et)2, D-Tic7, D-Tic9]O...)
Show SMILES CCOc1ccc(C[C@@H]2NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC2=O)[C@@H](C)CC)C(=O)N2Cc3ccccc3C[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)N2Cc3ccccc3C[C@@H]2C(N)=O)cc1
Show InChI InChI=1S/C58H77N11O12S2/c1-6-33(5)50-56(78)63-40(20-21-47(59)70)52(74)64-42(28-48(60)71)53(75)66-44(31-83-82-23-22-49(72)62-41(54(76)67-50)25-34-16-18-39(19-17-34)81-7-2)58(80)69-30-38-15-11-9-13-36(38)27-46(69)55(77)65-43(24-32(3)4)57(79)68-29-37-14-10-8-12-35(37)26-45(68)51(61)73/h8-19,32-33,40-46,50H,6-7,20-31H2,1-5H3,(H2,59,70)(H2,60,71)(H2,61,73)(H,62,72)(H,63,78)(H,64,74)(H,65,77)(H,66,75)(H,67,76)/t33-,40-,41-,42-,43-,44-,45+,46+,50?/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 25n/an/an/an/an/an/a



University of Patras

Curated by ChEMBL


Assay Description
Displacement of [3H]OT from human OT receptor expressed in HEK cells


Eur J Med Chem 42: 799-806 (2007)


Article DOI: 10.1016/j.ejmech.2006.12.016
BindingDB Entry DOI: 10.7270/Q2P55N5J
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50516427
PNG
(CHEMBL4466263)
Show SMILES COCc1nnc(N2CCC(C2)c2ccc(F)cc2Cl)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C20H21ClFN5O2/c1-28-12-18-24-25-20(27(18)15-4-6-19(29-2)23-10-15)26-8-7-13(11-26)16-5-3-14(22)9-17(16)21/h3-6,9-10,13H,7-8,11-12H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
PubMed
n/an/a 27n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50178153
PNG
(4-ethoxy-N-(4-methylphenyl)-N-{2-oxo-2-[2-(2-oxo-1...)
Show SMILES CCOc1ccc(cc1)S(=O)(=O)N(CC(=O)NN=C1C(=O)NC2C=CCC=C12)c1ccc(C)cc1
Show InChI InChI=1S/C25H26N4O5S/c1-3-34-19-12-14-20(15-13-19)35(32,33)29(18-10-8-17(2)9-11-18)16-23(30)27-28-24-21-6-4-5-7-22(21)26-25(24)31/h5-15,22H,3-4,16H2,1-2H3,(H,26,31)(H,27,30)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 30n/an/an/an/an/an/a



Serono Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human Oxytocin induced intracellular Calcium mobilization in human Oxytocin receptor transfected HEK293-EBNA cells


J Med Chem 48: 7882-905 (2005)


Article DOI: 10.1021/jm050645f
BindingDB Entry DOI: 10.7270/Q2QF8TN3
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50516413
PNG
(CHEMBL4564411)
Show SMILES COCc1nnc(N2C[C@@H]3C[C@@]3(C2)c2cccc(F)c2Cl)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H21ClFN5O2/c1-29-11-17-25-26-20(28(17)14-6-7-18(30-2)24-9-14)27-10-13-8-21(13,12-27)15-4-3-5-16(23)19(15)22/h3-7,9,13H,8,10-12H2,1-2H3/t13-,21-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
PubMed
n/an/a 30n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50410623
PNG
(CHEMBL2113179)
Show SMILES OCCCc1ccc(cc1)S(=O)(=O)N(CC(=O)N\N=C1/C(=O)Nc2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C25H23ClN4O5S/c26-18-9-11-19(12-10-18)30(36(34,35)20-13-7-17(8-14-20)4-3-15-31)16-23(32)28-29-24-21-5-1-2-6-22(21)27-25(24)33/h1-2,5-14,31H,3-4,15-16H2,(H,28,32)(H,27,29,33)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 32n/an/an/an/an/an/a



Serono Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human Oxytocin induced intracellular Calcium mobilization in human Oxytocin receptor transfected HEK293-EBNA cells


J Med Chem 48: 7882-905 (2005)


Article DOI: 10.1021/jm050645f
BindingDB Entry DOI: 10.7270/Q2QF8TN3
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50459404
PNG
(CHEMBL4205046)
Show SMILES Cc1ccn(n1)C(=O)Nc1ccc(C(=O)N2CCCCc3ccccc23)c(Cl)c1
Show InChI InChI=1S/C22H21ClN4O2/c1-15-11-13-27(25-15)22(29)24-17-9-10-18(19(23)14-17)21(28)26-12-5-4-7-16-6-2-3-8-20(16)26/h2-3,6,8-11,13-14H,4-5,7,12H2,1H3,(H,24,29)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
PubMed
n/an/a 37n/an/an/an/an/an/a



UMR7200 CNRS/Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Antagonist activity at OXR receptor (unknown origin)


J Med Chem 61: 8670-8692 (2018)


BindingDB Entry DOI: 10.7270/Q24J0HRF
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50205989
PNG
(CHEMBL393020 | [Mpa1, D-Tyr(Et)2, Pip7]OT)
Show SMILES CCOc1ccc(C[C@@H]2NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC2=O)[C@@H](C)CC)C(=O)N2CCCC[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)cc1
Show InChI InChI=1S/C46H71N11O12S2/c1-6-26(5)39-45(67)52-29(15-16-35(47)58)41(63)53-32(22-36(48)59)42(64)55-33(24-71-70-19-17-38(61)51-31(43(65)56-39)21-27-11-13-28(14-12-27)69-7-2)46(68)57-18-9-8-10-34(57)44(66)54-30(20-25(3)4)40(62)50-23-37(49)60/h11-14,25-26,29-34,39H,6-10,15-24H2,1-5H3,(H2,47,58)(H2,48,59)(H2,49,60)(H,50,62)(H,51,61)(H,52,67)(H,53,63)(H,54,66)(H,55,64)(H,56,65)/t26-,29-,30-,31-,32-,33-,34-,39?/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 40n/an/an/an/an/an/a



University of Patras

Curated by ChEMBL


Assay Description
Displacement of [3H]OT from human OT receptor expressed in HEK cells


Eur J Med Chem 42: 799-806 (2007)


Article DOI: 10.1016/j.ejmech.2006.12.016
BindingDB Entry DOI: 10.7270/Q2P55N5J
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50516414
PNG
(CHEMBL4538696)
Show SMILES COc1ccc(cn1)-n1c(COCCF)nnc1N1C[C@@H]2C[C@@]2(C1)c1ccc(F)cc1Cl
Show InChI InChI=1S/C22H22ClF2N5O2/c1-31-20-5-3-16(10-26-20)30-19(12-32-7-6-24)27-28-21(30)29-11-14-9-22(14,13-29)17-4-2-15(25)8-18(17)23/h2-5,8,10,14H,6-7,9,11-13H2,1H3/t14-,22-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
PubMed
n/an/a 44n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50410621
PNG
(CHEMBL2113177)
Show SMILES Clc1ccc(cc1)N(CC(=O)N\N=C1/C(=O)Nc2ccccc12)S(=O)(=O)c1ccc(NCCN2CCOCC2)cc1
Show InChI InChI=1S/C28H29ClN6O5S/c29-20-5-9-22(10-6-20)35(19-26(36)32-33-27-24-3-1-2-4-25(24)31-28(27)37)41(38,39)23-11-7-21(8-12-23)30-13-14-34-15-17-40-18-16-34/h1-12,30H,13-19H2,(H,32,36)(H,31,33,37)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 49n/an/an/an/an/an/a



Serono Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human Oxytocin induced intracellular Calcium mobilization in human Oxytocin receptor transfected HEK293-EBNA cells


J Med Chem 48: 7882-905 (2005)


Article DOI: 10.1021/jm050645f
BindingDB Entry DOI: 10.7270/Q2QF8TN3
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50205986
PNG
(CHEMBL233328 | [Mpa1, D-Tyr(Et)2, D-Tic7]OT)
Show SMILES CCOc1ccc(C[C@@H]2NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC2=O)[C@@H](C)CC)C(=O)N2Cc3ccccc3C[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)cc1
Show InChI InChI=1S/C50H71N11O12S2/c1-6-28(5)43-49(71)56-33(16-17-39(51)62)45(67)57-36(23-40(52)63)46(68)59-37(26-75-74-19-18-42(65)55-35(47(69)60-43)21-29-12-14-32(15-13-29)73-7-2)50(72)61-25-31-11-9-8-10-30(31)22-38(61)48(70)58-34(20-27(3)4)44(66)54-24-41(53)64/h8-15,27-28,33-38,43H,6-7,16-26H2,1-5H3,(H2,51,62)(H2,52,63)(H2,53,64)(H,54,66)(H,55,65)(H,56,71)(H,57,67)(H,58,70)(H,59,68)(H,60,69)/t28-,33-,34-,35-,36-,37-,38+,43?/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 51n/an/an/an/an/an/a



University of Patras

Curated by ChEMBL


Assay Description
Displacement of [3H]OT from human OT receptor expressed in HEK cells


Eur J Med Chem 42: 799-806 (2007)


Article DOI: 10.1016/j.ejmech.2006.12.016
BindingDB Entry DOI: 10.7270/Q2P55N5J
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50516416
PNG
(CHEMBL4541860)
Show SMILES COc1ccc(cn1)-n1c(nnc1N1C[C@@H]2C[C@@]2(C1)c1ccc(F)cc1Cl)C(F)F
Show InChI InChI=1S/C20H17ClF3N5O/c1-30-16-5-3-13(8-25-16)29-18(17(23)24)26-27-19(29)28-9-11-7-20(11,10-28)14-4-2-12(22)6-15(14)21/h2-6,8,11,17H,7,9-10H2,1H3/t11-,20-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
PubMed
n/an/a 52n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50206001
PNG
(CHEMBL233080 | [Mpa1, D-Tyr(Et)2, Aib7, D-Tic9]OT)
Show SMILES CCOc1ccc(C[C@@H]2NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC2=O)[C@@H](C)CC)C(=O)NC(C)(C)C(=O)N[C@@H](CC(C)C)C(=O)N2CCCC[C@@H]2C(N)=O)cc1
Show InChI InChI=1S/C48H75N11O12S2/c1-8-27(5)39-45(68)53-30(17-18-36(49)60)41(64)54-32(24-37(50)61)42(65)55-34(25-73-72-21-19-38(62)52-31(43(66)57-39)23-28-13-15-29(16-14-28)71-9-2)44(67)58-48(6,7)47(70)56-33(22-26(3)4)46(69)59-20-11-10-12-35(59)40(51)63/h13-16,26-27,30-35,39H,8-12,17-25H2,1-7H3,(H2,49,60)(H2,50,61)(H2,51,63)(H,52,62)(H,53,68)(H,54,64)(H,55,65)(H,56,70)(H,57,66)(H,58,67)/t27-,30-,31-,32-,33-,34-,35+,39?/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 55n/an/an/an/an/an/a



University of Patras

Curated by ChEMBL


Assay Description
Displacement of [3H]OT from human OT receptor expressed in HEK cells


Eur J Med Chem 42: 799-806 (2007)


Article DOI: 10.1016/j.ejmech.2006.12.016
BindingDB Entry DOI: 10.7270/Q2P55N5J
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50410622
PNG
(CHEMBL2113203)
Show SMILES CN(C)CCOc1ccc(cc1)S(=O)(=O)N(CC(=O)N\N=C1/C(=O)Nc2ccccc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C26H26ClN5O5S/c1-31(2)15-16-37-20-11-13-21(14-12-20)38(35,36)32(19-9-7-18(27)8-10-19)17-24(33)29-30-25-22-5-3-4-6-23(22)28-26(25)34/h3-14H,15-17H2,1-2H3,(H,29,33)(H,28,30,34)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 59n/an/an/an/an/an/a



Serono Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human Oxytocin induced intracellular Calcium mobilization in human Oxytocin receptor transfected HEK293-EBNA cells


J Med Chem 48: 7882-905 (2005)


Article DOI: 10.1021/jm050645f
BindingDB Entry DOI: 10.7270/Q2QF8TN3
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50177595
PNG
((2S)-5-amino-2-{[(2S)-1-{[(4R,7S,10S,13S,16R)-13-[...)
Show SMILES CCOc1ccc(C[C@H]2NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](NC(=O)[C@@H](NC2=O)[C@@H](C)CC)[C@@H](C)O)C(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCN)C(=O)NCC(N)=O)cc1
Show InChI InChI=1S/C43H67N11O12S2/c1-5-23(3)35-41(63)53-36(24(4)55)42(64)50-29(20-32(45)56)38(60)51-30(43(65)54-17-8-10-31(54)40(62)49-27(9-7-16-44)37(59)47-21-33(46)57)22-68-67-18-15-34(58)48-28(39(61)52-35)19-25-11-13-26(14-12-25)66-6-2/h11-14,23-24,27-31,35-36,55H,5-10,15-22,44H2,1-4H3,(H2,45,56)(H2,46,57)(H,47,59)(H,48,58)(H,49,62)(H,50,64)(H,51,60)(H,52,61)(H,53,63)/t23-,24+,27-,28+,29-,30-,31-,35-,36-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 59n/an/an/an/an/an/a



Serono Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory activity against human Oxytocin induced intracellular Calcium mobilization in human Oxytocin receptor transfected HEK293-EBNA cells


J Med Chem 48: 7882-905 (2005)


Article DOI: 10.1021/jm050645f
BindingDB Entry DOI: 10.7270/Q2QF8TN3
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50305506
PNG
(5-(3-(3-(2-chloro-4-fluorophenoxy)azetidin-1-yl)-5...)
Show SMILES COCc1nnc(N2CC(C2)Oc2ccc(F)cc2Cl)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C19H19ClFN5O3/c1-27-11-17-23-24-19(26(17)13-4-6-18(28-2)22-8-13)25-9-14(10-25)29-16-5-3-12(21)7-15(16)20/h3-8,14H,9-11H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 63n/an/an/an/an/an/a



UMR7200 CNRS/Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR receptor expressed in HEK293FT cells assessed as inhibition of LIT-001-induced response incubated for 30 mins by bet...


J Med Chem 61: 8670-8692 (2018)


BindingDB Entry DOI: 10.7270/Q24J0HRF
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50066092
PNG
(3N-[7,7-dimethyl-1-spiro[2,3-dihydro-1H-indene-1,4...)
Show SMILES CC1(C)C2CCC1(CS(=O)(=O)N1CCC3(CCc4ccccc34)CC1)C(C2)NC(=O)C1CCCNC1
Show InChI InChI=1S/C29H43N3O3S/c1-27(2)23-10-12-29(27,25(18-23)31-26(33)22-7-5-15-30-19-22)20-36(34,35)32-16-13-28(14-17-32)11-9-21-6-3-4-8-24(21)28/h3-4,6,8,22-23,25,30H,5,7,9-20H2,1-2H3,(H,31,33)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 68n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Antagonistic activity against Oxytocin receptor


J Med Chem 41: 3103-27 (1998)


Article DOI: 10.1021/jm970342o
BindingDB Entry DOI: 10.7270/Q2D799KH
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50206000
PNG
(CHEMBL395430 | [Aib7]OT)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](N)CSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)NC(C)(C)C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C42H66N12O12S2/c1-7-21(4)33-40(65)48-25(12-13-30(44)56)36(61)50-28(16-31(45)57)37(62)51-29(39(64)54-42(5,6)41(66)52-26(14-20(2)3)35(60)47-17-32(46)58)19-68-67-18-24(43)34(59)49-27(38(63)53-33)15-22-8-10-23(55)11-9-22/h8-11,20-21,24-29,33,55H,7,12-19,43H2,1-6H3,(H2,44,56)(H2,45,57)(H2,46,58)(H,47,60)(H,48,65)(H,49,59)(H,50,61)(H,51,62)(H,52,66)(H,53,63)(H,54,64)/t21-,24-,25-,26-,27-,28-,29-,33?/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 75n/an/an/an/an/an/a



University of Patras

Curated by ChEMBL


Assay Description
Displacement of [3H]OT from human OT receptor expressed in HEK cells


Eur J Med Chem 42: 799-806 (2007)


Article DOI: 10.1016/j.ejmech.2006.12.016
BindingDB Entry DOI: 10.7270/Q2P55N5J
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50205987
PNG
(CHEMBL438849 | [Mpa1, D-Tyr(Et)2, D-Tic7, Aib9]OT)
Show SMILES CCOc1ccc(C[C@@H]2NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC2=O)[C@@H](C)CC)C(=O)N2Cc3ccccc3C[C@@H]2C(=O)N[C@@H](CC(C)C)C(=O)NC(C)(C)C(N)=O)cc1
Show InChI InChI=1S/C52H75N11O12S2/c1-8-29(5)43-49(72)57-34(18-19-40(53)64)44(67)58-37(25-41(54)65)45(68)60-38(27-77-76-21-20-42(66)56-36(46(69)61-43)23-30-14-16-33(17-15-30)75-9-2)50(73)63-26-32-13-11-10-12-31(32)24-39(63)48(71)59-35(22-28(3)4)47(70)62-52(6,7)51(55)74/h10-17,28-29,34-39,43H,8-9,18-27H2,1-7H3,(H2,53,64)(H2,54,65)(H2,55,74)(H,56,66)(H,57,72)(H,58,67)(H,59,71)(H,60,68)(H,61,69)(H,62,70)/t29-,34-,35-,36-,37-,38-,39+,43?/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 80n/an/an/an/an/an/a



University of Patras

Curated by ChEMBL


Assay Description
Displacement of [3H]OT from human OT receptor expressed in HEK cells


Eur J Med Chem 42: 799-806 (2007)


Article DOI: 10.1016/j.ejmech.2006.12.016
BindingDB Entry DOI: 10.7270/Q2P55N5J
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50205992
PNG
(CHEMBL415418 | [Mpa1, L-Tic7]OT)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C48H67N11O12S2/c1-5-26(4)41-47(70)54-31(14-15-37(49)61)43(66)55-34(21-38(50)62)44(67)57-35(24-73-72-17-16-40(64)53-33(45(68)58-41)19-27-10-12-30(60)13-11-27)48(71)59-23-29-9-7-6-8-28(29)20-36(59)46(69)56-32(18-25(2)3)42(65)52-22-39(51)63/h6-13,25-26,31-36,41,60H,5,14-24H2,1-4H3,(H2,49,61)(H2,50,62)(H2,51,63)(H,52,65)(H,53,64)(H,54,70)(H,55,66)(H,56,69)(H,57,67)(H,58,68)/t26-,31-,32-,33-,34-,35-,36-,41?/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 103n/an/an/an/an/an/a



University of Patras

Curated by ChEMBL


Assay Description
Displacement of [3H]OT from human OT receptor expressed in HEK cells


Eur J Med Chem 42: 799-806 (2007)


Article DOI: 10.1016/j.ejmech.2006.12.016
BindingDB Entry DOI: 10.7270/Q2P55N5J
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50307117
PNG
(CHEMBL603708 | N-(4-(2,3,4,5-tetrahydro-1H-benzo[b...)
Show SMILES O=C(Nc1ccc(cc1)C(=O)N1CCCCc2ccccc12)c1ccccc1-c1ccccc1
Show InChI InChI=1S/C30H26N2O2/c33-29(27-15-6-5-14-26(27)22-10-2-1-3-11-22)31-25-19-17-24(18-20-25)30(34)32-21-9-8-13-23-12-4-7-16-28(23)32/h1-7,10-12,14-20H,8-9,13,21H2,(H,31,33)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 109n/an/an/an/an/an/a



UMR7200 CNRS/Universit£ de Strasbourg

Curated by ChEMBL


Assay Description
Antagonist activity at OXR receptor (unknown origin)


J Med Chem 61: 8670-8692 (2018)


BindingDB Entry DOI: 10.7270/Q24J0HRF
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50516429
PNG
(CHEMBL4444840)
Show SMILES COCc1nnc(N2CC3CN(C3C2)c2ccc(F)cc2Cl)n1-c1ccc(OC)nc1
Show InChI InChI=1S/C21H22ClFN6O2/c1-30-12-19-25-26-21(29(19)15-4-6-20(31-2)24-8-15)27-9-13-10-28(18(13)11-27)17-5-3-14(23)7-16(17)22/h3-8,13,18H,9-12H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
PubMed
n/an/a 121n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50133272
PNG
(CHEMBL406351 | [D-Pen1,Glu4,Lys8]OT)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@H](N)C(C)(C)SSC[C@@H]2NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](CCC(=O)NCCCC[C@@H](NC(=O)[C@H]3CCCN3C2=O)C(=O)NCC(N)=O)NC1=O
Show InChI InChI=1S/C45H68N12O12S2/c1-5-23(2)35-42(67)52-27-15-16-34(61)49-17-7-6-9-26(37(62)50-21-33(47)60)51-41(66)31-10-8-18-57(31)44(69)30(55-39(64)29(20-32(46)59)53-38(27)63)22-70-71-45(3,4)36(48)43(68)54-28(40(65)56-35)19-24-11-13-25(58)14-12-24/h11-14,23,26-31,35-36,58H,5-10,15-22,48H2,1-4H3,(H2,46,59)(H2,47,60)(H,49,61)(H,50,62)(H,51,66)(H,52,67)(H,53,63)(H,54,68)(H,55,64)(H,56,65)/t23-,26+,27+,28+,29+,30-,31+,35-,36-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 130n/an/an/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
Binding affinity towards oxytocin receptor


J Med Chem 46: 4215-31 (2003)


Article DOI: 10.1021/jm0303103
BindingDB Entry DOI: 10.7270/Q2JW8FM1
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50205996
PNG
(CHEMBL397407 | [L-Tic7]OT)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](N)CSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC1=O)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C48H68N12O12S2/c1-5-25(4)40-47(71)54-31(14-15-37(50)62)43(67)56-34(19-38(51)63)44(68)58-35(23-74-73-22-30(49)41(65)55-33(45(69)59-40)17-26-10-12-29(61)13-11-26)48(72)60-21-28-9-7-6-8-27(28)18-36(60)46(70)57-32(16-24(2)3)42(66)53-20-39(52)64/h6-13,24-25,30-36,40,61H,5,14-23,49H2,1-4H3,(H2,50,62)(H2,51,63)(H2,52,64)(H,53,66)(H,54,71)(H,55,65)(H,56,67)(H,57,70)(H,58,68)(H,59,69)/t25-,30-,31-,32-,33-,34-,35-,36-,40?/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 130n/an/an/an/an/an/a



University of Patras

Curated by ChEMBL


Assay Description
Displacement of [3H]OT from human OT receptor expressed in HEK cells


Eur J Med Chem 42: 799-806 (2007)


Article DOI: 10.1016/j.ejmech.2006.12.016
BindingDB Entry DOI: 10.7270/Q2P55N5J
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50066084
PNG
(3N-[7,7-dimethyl-1-spiro[2,3-dihydro-1H-indene-1,4...)
Show SMILES C[C@@H](O)CN1CCC[C@H](C1)C(=O)NC1CC2CCC1(CS(=O)(=O)N1CCC3(CCc4ccccc34)CC1)C2(C)C
Show InChI InChI=1S/C32H49N3O4S/c1-23(36)20-34-16-6-8-25(21-34)29(37)33-28-19-26-11-13-32(28,30(26,2)3)22-40(38,39)35-17-14-31(15-18-35)12-10-24-7-4-5-9-27(24)31/h4-5,7,9,23,25-26,28,36H,6,8,10-22H2,1-3H3,(H,33,37)/t23-,25-,26?,28?,32?/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 130n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Antagonistic activity against Oxytocin receptor


J Med Chem 41: 3103-27 (1998)


Article DOI: 10.1021/jm970342o
BindingDB Entry DOI: 10.7270/Q2D799KH
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50516420
PNG
(CHEMBL4437214)
Show SMILES COCc1nnc(N2C[C@@H]3C[C@@]3(C2)c2ccc(F)cc2Cl)n1-c1ccc2OCOc2c1
Show InChI InChI=1S/C22H20ClFN4O3/c1-29-10-20-25-26-21(28(20)15-3-5-18-19(7-15)31-12-30-18)27-9-13-8-22(13,11-27)16-4-2-14(24)6-17(16)23/h2-7,13H,8-12H2,1H3/t13-,22-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
PubMed
n/an/a 132n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50133258
PNG
(CHEMBL2369135 | [D-Pen1,(2S,3R)-p-MeOTMT2,Glu4,Lys...)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](NC(=O)[C@H](N)C(C)(C)SSC[C@@H]2NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](CCC(=O)NCCCC[C@@H](NC(=O)[C@H]3CCCN3C2=O)C(=O)NCC(N)=O)NC1=O)[C@H](C)c1c(C)cc(OC)cc1C
Show InChI InChI=1S/C49H76N12O12S2/c1-9-24(2)38-45(69)56-30-15-16-36(64)53-17-11-10-13-29(41(65)54-22-35(51)63)55-44(68)33-14-12-18-61(33)48(72)32(58-43(67)31(21-34(50)62)57-42(30)66)23-74-75-49(6,7)40(52)47(71)60-39(46(70)59-38)27(5)37-25(3)19-28(73-8)20-26(37)4/h19-20,24,27,29-33,38-40H,9-18,21-23,52H2,1-8H3,(H2,50,62)(H2,51,63)(H,53,64)(H,54,65)(H,55,68)(H,56,69)(H,57,66)(H,58,67)(H,59,70)(H,60,71)/t24-,27-,29+,30+,31+,32-,33+,38-,39?,40-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 160n/an/an/an/an/an/a



University of Arizona

Curated by ChEMBL


Assay Description
Binding affinity towards oxytocin receptor


J Med Chem 46: 4215-31 (2003)


Article DOI: 10.1021/jm0303103
BindingDB Entry DOI: 10.7270/Q2JW8FM1
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50205995
PNG
(CHEMBL234377 | [Mpa1, D-Tyr(Et)2, L-Tic7]OT)
Show SMILES CCOc1ccc(C[C@@H]2NC(=O)CCSSC[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC2=O)[C@@H](C)CC)C(=O)N2Cc3ccccc3C[C@H]2C(=O)N[C@@H](CC(C)C)C(=O)NCC(N)=O)cc1
Show InChI InChI=1S/C50H71N11O12S2/c1-6-28(5)43-49(71)56-33(16-17-39(51)62)45(67)57-36(23-40(52)63)46(68)59-37(26-75-74-19-18-42(65)55-35(47(69)60-43)21-29-12-14-32(15-13-29)73-7-2)50(72)61-25-31-11-9-8-10-30(31)22-38(61)48(70)58-34(20-27(3)4)44(66)54-24-41(53)64/h8-15,27-28,33-38,43H,6-7,16-26H2,1-5H3,(H2,51,62)(H2,52,63)(H2,53,64)(H,54,66)(H,55,65)(H,56,71)(H,57,67)(H,58,70)(H,59,68)(H,60,69)/t28-,33-,34-,35-,36-,37-,38-,43?/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 176n/an/an/an/an/an/a



University of Patras

Curated by ChEMBL


Assay Description
Displacement of [3H]OT from human OT receptor expressed in HEK cells


Eur J Med Chem 42: 799-806 (2007)


Article DOI: 10.1016/j.ejmech.2006.12.016
BindingDB Entry DOI: 10.7270/Q2P55N5J
More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50516415
PNG
(CHEMBL4585239)
Show SMILES COc1ccc(cn1)-n1c(CO[C@H]2CCOC2)nnc1N1C[C@@H]2C[C@@]2(C1)c1ccc(F)cc1Cl
Show InChI InChI=1S/C24H25ClFN5O3/c1-32-22-5-3-17(10-27-22)31-21(13-34-18-6-7-33-12-18)28-29-23(31)30-11-15-9-24(15,14-30)19-4-2-16(26)8-20(19)25/h2-5,8,10,15,18H,6-7,9,11-14H2,1H3/t15-,18-,24-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
PubMed
n/an/a 184n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50516422
PNG
(CHEMBL4542267)
Show SMILES COc1ccc(cn1)-n1c(CO[C@@H]2CCOC2)nnc1N1C[C@@H]2C[C@@]2(C1)c1ccc(F)cc1Cl
Show InChI InChI=1S/C24H25ClFN5O3/c1-32-22-5-3-17(10-27-22)31-21(13-34-18-6-7-33-12-18)28-29-23(31)30-11-15-9-24(15,14-30)19-4-2-16(26)8-20(19)25/h2-5,8,10,15,18H,6-7,9,11-14H2,1H3/t15-,18+,24-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
PubMed
n/an/a 223n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50516424
PNG
(CHEMBL4575160)
Show SMILES COc1ccc(cn1)-n1c(CC#N)nnc1N1C[C@@H]2C[C@@]2(C1)c1ccc(F)cc1Cl
Show InChI InChI=1S/C21H18ClFN6O/c1-30-19-5-3-15(10-25-19)29-18(6-7-24)26-27-20(29)28-11-13-9-21(13,12-28)16-4-2-14(23)8-17(16)22/h2-5,8,10,13H,6,9,11-12H2,1H3/t13-,21-/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
UniChem
PubMed
n/an/a 235n/an/an/an/an/an/a



Shanghai Hengrui Pharmaceutical CO., LTD.

Curated by ChEMBL


Assay Description
Antagonist activity at human OTR expressed in HEK293 cells assessed as decrease in calcium flux measured after 10 mins in presence of vasopressin by ...


ACS Med Chem Lett 10: 996-1001 (2019)

More data for this
Ligand-Target Pair
Oxytocin receptor


(Homo sapiens (Human))
BDBM50177593
PNG
((5H,11H-benzo[e]pyrrolo[1,2-a][1,4]diazepin-10-yl)...)
Show SMILES Cc1ccn(n1)-c1ccc(C(=O)N2Cc3cccn3Cc3ccccc23)c(Cl)c1
Show InChI InChI=1S/C23H19ClN4O/c1-16-10-12-28(25-16)18-8-9-20(21(24)13-18)23(29)27-15-19-6-4-11-26(19)14-17-5-2-3-7-22(17)27/h2-13H,14-15H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 353n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]oxytocin from human oxytocin receptor expressed in CHO cells


Bioorg Med Chem Lett 17: 5796-800 (2007)


Article DOI: 10.1016/j.bmcl.2007.08.053
BindingDB Entry DOI: 10.7270/Q2NV9J05
More data for this
Ligand-Target Pair
Displayed 1 to 50 (of 129 total )  |  Next  |  Last  >>
Jump to: