Found 6 hits for monomerid = 50164312 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 |
|---|
Sodium channel protein type 5 subunit alpha
(Homo sapiens (Human)) | BDBM50164312
(CHEMBL3797725)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCCN(C)C)NC(=O)[C@]1([H])CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]3([H])CSSC[C@]([H])(NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC2=O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2c[nH]c4ccccc24)C(=O)N[C@@H](CSSC[C@]([H])(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@]2([H])CCCN2C(=O)[C@@]([H])(NC3=O)[C@@H](C)CC)C(=O)N1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C178H275N51O45S7/c1-15-95(10)142-176(274)229-66-37-52-133(229)171(269)214-124(79-139(240)241)160(258)211-121(76-134(184)233)157(255)212-123(78-138(238)239)159(257)201-109(47-27-32-61-182)151(249)218-129-87-279-277-85-127(164(262)203-107(45-25-30-59-180)148(246)209-118(72-99-53-55-102(232)56-54-99)162(260)224-140(93(6)7)172(270)206-114(144(186)242)70-97-38-18-16-19-39-97)220-155(253)119(73-100-80-194-105-43-23-22-42-103(100)105)210-149(247)106(44-24-29-58-179)200-156(254)120(74-101-81-191-90-196-101)215-174(272)143(96(11)231)226-153(251)111(50-35-63-193-178(189)190)202-163(261)125(83-230)216-167(265)130-88-280-281-89-131(169(267)225-142)219-150(248)108(46-26-31-60-181)198-147(245)110(49-34-62-192-177(187)188)199-152(250)112(57-67-275-14)204-154(252)117(71-98-40-20-17-21-41-98)197-136(235)82-195-146(244)115(68-91(2)3)207-166(264)126(217-145(243)104(183)75-137(236)237)84-276-278-86-128(221-168(129)266)165(263)205-113(48-28-33-64-227(12)13)175(273)228-65-36-51-132(228)170(268)213-122(77-135(185)234)158(256)208-116(69-92(4)5)161(259)223-141(94(8)9)173(271)222-130/h16-23,38-43,53-56,80-81,90-96,104,106-133,140-143,194,230-232H,15,24-37,44-52,57-79,82-89,179-183H2,1-14H3,(H2,184,233)(H2,185,234)(H2,186,242)(H,191,196)(H,195,244)(H,197,235)(H,198,245)(H,199,250)(H,200,254)(H,201,257)(H,202,261)(H,203,262)(H,204,252)(H,205,263)(H,206,270)(H,207,264)(H,208,256)(H,209,246)(H,210,247)(H,211,258)(H,212,255)(H,213,268)(H,214,269)(H,215,272)(H,216,265)(H,217,243)(H,218,249)(H,219,248)(H,220,253)(H,221,266)(H,222,271)(H,223,259)(H,224,260)(H,225,267)(H,226,251)(H,236,237)(H,238,239)(H,240,241)(H4,187,188,192)(H4,189,190,193)/t95-,96+,104-,106-,107-,108-,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-,140-,141-,142-,143-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.5 expressed in HEK293 cells by whole cell patch clamp electrophysiology method |
J Med Chem 59: 2704-17 (2016)
BindingDB Entry DOI: 10.7270/Q2S184D5 |
More data for this
Ligand-Target Pair | |
Voltage-gated sodium channel subunit alpha Nav1.4 (Nav1.4)
(Homo sapiens (Human)) | BDBM50164312
(CHEMBL3797725)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCCN(C)C)NC(=O)[C@]1([H])CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]3([H])CSSC[C@]([H])(NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC2=O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2c[nH]c4ccccc24)C(=O)N[C@@H](CSSC[C@]([H])(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@]2([H])CCCN2C(=O)[C@@]([H])(NC3=O)[C@@H](C)CC)C(=O)N1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C178H275N51O45S7/c1-15-95(10)142-176(274)229-66-37-52-133(229)171(269)214-124(79-139(240)241)160(258)211-121(76-134(184)233)157(255)212-123(78-138(238)239)159(257)201-109(47-27-32-61-182)151(249)218-129-87-279-277-85-127(164(262)203-107(45-25-30-59-180)148(246)209-118(72-99-53-55-102(232)56-54-99)162(260)224-140(93(6)7)172(270)206-114(144(186)242)70-97-38-18-16-19-39-97)220-155(253)119(73-100-80-194-105-43-23-22-42-103(100)105)210-149(247)106(44-24-29-58-179)200-156(254)120(74-101-81-191-90-196-101)215-174(272)143(96(11)231)226-153(251)111(50-35-63-193-178(189)190)202-163(261)125(83-230)216-167(265)130-88-280-281-89-131(169(267)225-142)219-150(248)108(46-26-31-60-181)198-147(245)110(49-34-62-192-177(187)188)199-152(250)112(57-67-275-14)204-154(252)117(71-98-40-20-17-21-41-98)197-136(235)82-195-146(244)115(68-91(2)3)207-166(264)126(217-145(243)104(183)75-137(236)237)84-276-278-86-128(221-168(129)266)165(263)205-113(48-28-33-64-227(12)13)175(273)228-65-36-51-132(228)170(268)213-122(77-135(185)234)158(256)208-116(69-92(4)5)161(259)223-141(94(8)9)173(271)222-130/h16-23,38-43,53-56,80-81,90-96,104,106-133,140-143,194,230-232H,15,24-37,44-52,57-79,82-89,179-183H2,1-14H3,(H2,184,233)(H2,185,234)(H2,186,242)(H,191,196)(H,195,244)(H,197,235)(H,198,245)(H,199,250)(H,200,254)(H,201,257)(H,202,261)(H,203,262)(H,204,252)(H,205,263)(H,206,270)(H,207,264)(H,208,256)(H,209,246)(H,210,247)(H,211,258)(H,212,255)(H,213,268)(H,214,269)(H,215,272)(H,216,265)(H,217,243)(H,218,249)(H,219,248)(H,220,253)(H,221,266)(H,222,271)(H,223,259)(H,224,260)(H,225,267)(H,226,251)(H,236,237)(H,238,239)(H,240,241)(H4,187,188,192)(H4,189,190,193)/t95-,96+,104-,106-,107-,108-,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-,140-,141-,142-,143-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 720 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.4 expressed in HEK293 cells by whole cell patch clamp electrophysiology method |
J Med Chem 59: 2704-17 (2016)
BindingDB Entry DOI: 10.7270/Q2S184D5 |
More data for this
Ligand-Target Pair | |
Voltage-gated sodium channel subunit alpha Nav1.4 (Nav1.4)
(Homo sapiens (Human)) | BDBM50164312
(CHEMBL3797725)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCCN(C)C)NC(=O)[C@]1([H])CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]3([H])CSSC[C@]([H])(NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC2=O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2c[nH]c4ccccc24)C(=O)N[C@@H](CSSC[C@]([H])(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@]2([H])CCCN2C(=O)[C@@]([H])(NC3=O)[C@@H](C)CC)C(=O)N1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C178H275N51O45S7/c1-15-95(10)142-176(274)229-66-37-52-133(229)171(269)214-124(79-139(240)241)160(258)211-121(76-134(184)233)157(255)212-123(78-138(238)239)159(257)201-109(47-27-32-61-182)151(249)218-129-87-279-277-85-127(164(262)203-107(45-25-30-59-180)148(246)209-118(72-99-53-55-102(232)56-54-99)162(260)224-140(93(6)7)172(270)206-114(144(186)242)70-97-38-18-16-19-39-97)220-155(253)119(73-100-80-194-105-43-23-22-42-103(100)105)210-149(247)106(44-24-29-58-179)200-156(254)120(74-101-81-191-90-196-101)215-174(272)143(96(11)231)226-153(251)111(50-35-63-193-178(189)190)202-163(261)125(83-230)216-167(265)130-88-280-281-89-131(169(267)225-142)219-150(248)108(46-26-31-60-181)198-147(245)110(49-34-62-192-177(187)188)199-152(250)112(57-67-275-14)204-154(252)117(71-98-40-20-17-21-41-98)197-136(235)82-195-146(244)115(68-91(2)3)207-166(264)126(217-145(243)104(183)75-137(236)237)84-276-278-86-128(221-168(129)266)165(263)205-113(48-28-33-64-227(12)13)175(273)228-65-36-51-132(228)170(268)213-122(77-135(185)234)158(256)208-116(69-92(4)5)161(259)223-141(94(8)9)173(271)222-130/h16-23,38-43,53-56,80-81,90-96,104,106-133,140-143,194,230-232H,15,24-37,44-52,57-79,82-89,179-183H2,1-14H3,(H2,184,233)(H2,185,234)(H2,186,242)(H,191,196)(H,195,244)(H,197,235)(H,198,245)(H,199,250)(H,200,254)(H,201,257)(H,202,261)(H,203,262)(H,204,252)(H,205,263)(H,206,270)(H,207,264)(H,208,256)(H,209,246)(H,210,247)(H,211,258)(H,212,255)(H,213,268)(H,214,269)(H,215,272)(H,216,265)(H,217,243)(H,218,249)(H,219,248)(H,220,253)(H,221,266)(H,222,271)(H,223,259)(H,224,260)(H,225,267)(H,226,251)(H,236,237)(H,238,239)(H,240,241)(H4,187,188,192)(H4,189,190,193)/t95-,96+,104-,106-,107-,108-,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-,140-,141-,142-,143-/m0/s1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.4 expressed in HEK293 cells assessed as inward peak current by ion-works quattro patch clamp electrophysiology method |
J Med Chem 59: 2704-17 (2016)
BindingDB Entry DOI: 10.7270/Q2S184D5 |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50164312
(CHEMBL3797725)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCCN(C)C)NC(=O)[C@]1([H])CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]3([H])CSSC[C@]([H])(NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC2=O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2c[nH]c4ccccc24)C(=O)N[C@@H](CSSC[C@]([H])(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@]2([H])CCCN2C(=O)[C@@]([H])(NC3=O)[C@@H](C)CC)C(=O)N1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C178H275N51O45S7/c1-15-95(10)142-176(274)229-66-37-52-133(229)171(269)214-124(79-139(240)241)160(258)211-121(76-134(184)233)157(255)212-123(78-138(238)239)159(257)201-109(47-27-32-61-182)151(249)218-129-87-279-277-85-127(164(262)203-107(45-25-30-59-180)148(246)209-118(72-99-53-55-102(232)56-54-99)162(260)224-140(93(6)7)172(270)206-114(144(186)242)70-97-38-18-16-19-39-97)220-155(253)119(73-100-80-194-105-43-23-22-42-103(100)105)210-149(247)106(44-24-29-58-179)200-156(254)120(74-101-81-191-90-196-101)215-174(272)143(96(11)231)226-153(251)111(50-35-63-193-178(189)190)202-163(261)125(83-230)216-167(265)130-88-280-281-89-131(169(267)225-142)219-150(248)108(46-26-31-60-181)198-147(245)110(49-34-62-192-177(187)188)199-152(250)112(57-67-275-14)204-154(252)117(71-98-40-20-17-21-41-98)197-136(235)82-195-146(244)115(68-91(2)3)207-166(264)126(217-145(243)104(183)75-137(236)237)84-276-278-86-128(221-168(129)266)165(263)205-113(48-28-33-64-227(12)13)175(273)228-65-36-51-132(228)170(268)213-122(77-135(185)234)158(256)208-116(69-92(4)5)161(259)223-141(94(8)9)173(271)222-130/h16-23,38-43,53-56,80-81,90-96,104,106-133,140-143,194,230-232H,15,24-37,44-52,57-79,82-89,179-183H2,1-14H3,(H2,184,233)(H2,185,234)(H2,186,242)(H,191,196)(H,195,244)(H,197,235)(H,198,245)(H,199,250)(H,200,254)(H,201,257)(H,202,261)(H,203,262)(H,204,252)(H,205,263)(H,206,270)(H,207,264)(H,208,256)(H,209,246)(H,210,247)(H,211,258)(H,212,255)(H,213,268)(H,214,269)(H,215,272)(H,216,265)(H,217,243)(H,218,249)(H,219,248)(H,220,253)(H,221,266)(H,222,271)(H,223,259)(H,224,260)(H,225,267)(H,226,251)(H,236,237)(H,238,239)(H,240,241)(H4,187,188,192)(H4,189,190,193)/t95-,96+,104-,106-,107-,108-,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-,140-,141-,142-,143-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 expressed in HEK293 cells by whole cell patch clamp electrophysiology method |
J Med Chem 59: 2704-17 (2016)
BindingDB Entry DOI: 10.7270/Q2S184D5 |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 5 subunit alpha
(Homo sapiens (Human)) | BDBM50164312
(CHEMBL3797725)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCCN(C)C)NC(=O)[C@]1([H])CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]3([H])CSSC[C@]([H])(NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC2=O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2c[nH]c4ccccc24)C(=O)N[C@@H](CSSC[C@]([H])(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@]2([H])CCCN2C(=O)[C@@]([H])(NC3=O)[C@@H](C)CC)C(=O)N1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C178H275N51O45S7/c1-15-95(10)142-176(274)229-66-37-52-133(229)171(269)214-124(79-139(240)241)160(258)211-121(76-134(184)233)157(255)212-123(78-138(238)239)159(257)201-109(47-27-32-61-182)151(249)218-129-87-279-277-85-127(164(262)203-107(45-25-30-59-180)148(246)209-118(72-99-53-55-102(232)56-54-99)162(260)224-140(93(6)7)172(270)206-114(144(186)242)70-97-38-18-16-19-39-97)220-155(253)119(73-100-80-194-105-43-23-22-42-103(100)105)210-149(247)106(44-24-29-58-179)200-156(254)120(74-101-81-191-90-196-101)215-174(272)143(96(11)231)226-153(251)111(50-35-63-193-178(189)190)202-163(261)125(83-230)216-167(265)130-88-280-281-89-131(169(267)225-142)219-150(248)108(46-26-31-60-181)198-147(245)110(49-34-62-192-177(187)188)199-152(250)112(57-67-275-14)204-154(252)117(71-98-40-20-17-21-41-98)197-136(235)82-195-146(244)115(68-91(2)3)207-166(264)126(217-145(243)104(183)75-137(236)237)84-276-278-86-128(221-168(129)266)165(263)205-113(48-28-33-64-227(12)13)175(273)228-65-36-51-132(228)170(268)213-122(77-135(185)234)158(256)208-116(69-92(4)5)161(259)223-141(94(8)9)173(271)222-130/h16-23,38-43,53-56,80-81,90-96,104,106-133,140-143,194,230-232H,15,24-37,44-52,57-79,82-89,179-183H2,1-14H3,(H2,184,233)(H2,185,234)(H2,186,242)(H,191,196)(H,195,244)(H,197,235)(H,198,245)(H,199,250)(H,200,254)(H,201,257)(H,202,261)(H,203,262)(H,204,252)(H,205,263)(H,206,270)(H,207,264)(H,208,256)(H,209,246)(H,210,247)(H,211,258)(H,212,255)(H,213,268)(H,214,269)(H,215,272)(H,216,265)(H,217,243)(H,218,249)(H,219,248)(H,220,253)(H,221,266)(H,222,271)(H,223,259)(H,224,260)(H,225,267)(H,226,251)(H,236,237)(H,238,239)(H,240,241)(H4,187,188,192)(H4,189,190,193)/t95-,96+,104-,106-,107-,108-,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-,140-,141-,142-,143-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.5 expressed in HEK293 cells assessed as inward peak current by ion-works quattro patch clamp electrophysiology method |
J Med Chem 59: 2704-17 (2016)
BindingDB Entry DOI: 10.7270/Q2S184D5 |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50164312
(CHEMBL3797725)Show SMILES [H][C@@]12CCCN1C(=O)[C@H](CCCCN(C)C)NC(=O)[C@]1([H])CSSC[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](Cc3ccccc3)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@]3([H])CSSC[C@]([H])(NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC2=O)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@]([H])([C@@H](C)O)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc2c[nH]c4ccccc24)C(=O)N[C@@H](CSSC[C@]([H])(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@]2([H])CCCN2C(=O)[C@@]([H])(NC3=O)[C@@H](C)CC)C(=O)N1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r| Show InChI InChI=1S/C178H275N51O45S7/c1-15-95(10)142-176(274)229-66-37-52-133(229)171(269)214-124(79-139(240)241)160(258)211-121(76-134(184)233)157(255)212-123(78-138(238)239)159(257)201-109(47-27-32-61-182)151(249)218-129-87-279-277-85-127(164(262)203-107(45-25-30-59-180)148(246)209-118(72-99-53-55-102(232)56-54-99)162(260)224-140(93(6)7)172(270)206-114(144(186)242)70-97-38-18-16-19-39-97)220-155(253)119(73-100-80-194-105-43-23-22-42-103(100)105)210-149(247)106(44-24-29-58-179)200-156(254)120(74-101-81-191-90-196-101)215-174(272)143(96(11)231)226-153(251)111(50-35-63-193-178(189)190)202-163(261)125(83-230)216-167(265)130-88-280-281-89-131(169(267)225-142)219-150(248)108(46-26-31-60-181)198-147(245)110(49-34-62-192-177(187)188)199-152(250)112(57-67-275-14)204-154(252)117(71-98-40-20-17-21-41-98)197-136(235)82-195-146(244)115(68-91(2)3)207-166(264)126(217-145(243)104(183)75-137(236)237)84-276-278-86-128(221-168(129)266)165(263)205-113(48-28-33-64-227(12)13)175(273)228-65-36-51-132(228)170(268)213-122(77-135(185)234)158(256)208-116(69-92(4)5)161(259)223-141(94(8)9)173(271)222-130/h16-23,38-43,53-56,80-81,90-96,104,106-133,140-143,194,230-232H,15,24-37,44-52,57-79,82-89,179-183H2,1-14H3,(H2,184,233)(H2,185,234)(H2,186,242)(H,191,196)(H,195,244)(H,197,235)(H,198,245)(H,199,250)(H,200,254)(H,201,257)(H,202,261)(H,203,262)(H,204,252)(H,205,263)(H,206,270)(H,207,264)(H,208,256)(H,209,246)(H,210,247)(H,211,258)(H,212,255)(H,213,268)(H,214,269)(H,215,272)(H,216,265)(H,217,243)(H,218,249)(H,219,248)(H,220,253)(H,221,266)(H,222,271)(H,223,259)(H,224,260)(H,225,267)(H,226,251)(H,236,237)(H,238,239)(H,240,241)(H4,187,188,192)(H4,189,190,193)/t95-,96+,104-,106-,107-,108-,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-,140-,141-,142-,143-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 210 | n/a | n/a | n/a | n/a | n/a | n/a |
Amgen Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 expressed in HEK293 cells assessed as inward peak current by ion-works quattro patch clamp electrophysiology method |
J Med Chem 59: 2704-17 (2016)
BindingDB Entry DOI: 10.7270/Q2S184D5 |
More data for this
Ligand-Target Pair | |
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