Found 39 hits with Last Name = 'seifert' and Initial = 'k' Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Histamine H1 receptor
(Cavia porcellus (domestic guinea pig)) | BDBM86174
(CAS_486-12-4 | NSC_5282443 | Triprolidine)Show InChI InChI=1S/C19H22N2/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21/h2-3,6-12H,4-5,13-15H2,1H3 | UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
Similars
| Article PubMed
| 1.15 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM86174
(CAS_486-12-4 | NSC_5282443 | Triprolidine)Show InChI InChI=1S/C19H22N2/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21/h2-3,6-12H,4-5,13-15H2,1H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
Similars
| Article PubMed
| 3.01 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Cavia porcellus (domestic guinea pig)) | BDBM86171
(Arpromidine | CAS_65895 | NSC_65895)Show SMILES NC(NCCCc1cnc[nH]1)=NCCC(c1ccc(F)cc1)c1ccccn1 |w:11.12| Show InChI InChI=1S/C21H25FN6/c22-17-8-6-16(7-9-17)19(20-5-1-2-11-25-20)10-13-27-21(23)26-12-3-4-18-14-24-15-28-18/h1-2,5-9,11,14-15,19H,3-4,10,12-13H2,(H,24,28)(H3,23,26,27) | UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 33.3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Cavia porcellus (domestic guinea pig)) | BDBM86169
(BU-E 47)Show SMILES NC(NCCCc1cnc[nH]1)=NCCC(c1cccc(Cl)c1)c1ccccn1 |w:11.12| Show InChI InChI=1S/C21H25ClN6/c22-17-6-3-5-16(13-17)19(20-8-1-2-10-25-20)9-12-27-21(23)26-11-4-7-18-14-24-15-28-18/h1-3,5-6,8,10,13-15,19H,4,7,9,11-12H2,(H,24,28)(H3,23,26,27) | UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 53.9 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM86169
(BU-E 47)Show SMILES NC(NCCCc1cnc[nH]1)=NCCC(c1cccc(Cl)c1)c1ccccn1 |w:11.12| Show InChI InChI=1S/C21H25ClN6/c22-17-6-3-5-16(13-17)19(20-8-1-2-10-25-20)9-12-27-21(23)26-11-4-7-18-14-24-15-28-18/h1-3,5-6,8,10,13-15,19H,4,7,9,11-12H2,(H,24,28)(H3,23,26,27) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 255 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Cavia porcellus (domestic guinea pig)) | BDBM86175
(Methylhistaprodifen | N-Methyl-2-(3,3-diphenylprop...)Show InChI InChI=1S/C21H25N3/c1-22-15-14-19-16-23-21(24-19)13-12-20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,16,20,22H,12-15H2,1H3,(H,23,24) | UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
Similars
| Article PubMed
| 290 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Cavia porcellus (domestic guinea pig)) | BDBM86170
(Dimethylhistaprodifen | N,N-Dimethyl-2-(3,3-diphen...)Show InChI InChI=1S/C22H27N3/c1-25(2)16-15-20-17-23-22(24-20)14-13-21(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,17,21H,13-16H2,1-2H3,(H,23,24) | UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| 310 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM86171
(Arpromidine | CAS_65895 | NSC_65895)Show SMILES NC(NCCCc1cnc[nH]1)=NCCC(c1ccc(F)cc1)c1ccccn1 |w:11.12| Show InChI InChI=1S/C21H25FN6/c22-17-8-6-16(7-9-17)19(20-5-1-2-11-25-20)10-13-27-21(23)26-12-3-4-18-14-24-15-28-18/h1-2,5-9,11,14-15,19H,3-4,10,12-13H2,(H,24,28)(H3,23,26,27) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| 353 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM86175
(Methylhistaprodifen | N-Methyl-2-(3,3-diphenylprop...)Show InChI InChI=1S/C21H25N3/c1-22-15-14-19-16-23-21(24-19)13-12-20(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-11,16,20,22H,12-15H2,1H3,(H,23,24) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
Similars
| Article PubMed
| 370 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM86170
(Dimethylhistaprodifen | N,N-Dimethyl-2-(3,3-diphen...)Show InChI InChI=1S/C22H27N3/c1-25(2)16-15-20-17-23-22(24-20)14-13-21(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,17,21H,13-16H2,1-2H3,(H,23,24) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| Article PubMed
| 400 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Cavia porcellus (domestic guinea pig)) | BDBM86172
(2-(3-Chlorophenyl)histamine)Show InChI InChI=1S/C11H12ClN3/c12-9-3-1-2-8(6-9)11-14-7-10(15-11)4-5-13/h1-3,6-7H,4-5,13H2,(H,14,15) | UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
Similars
| Article PubMed
| 600 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Cavia porcellus (domestic guinea pig)) | BDBM86173
(2-(3-Iodophenyl)histamine)Show InChI InChI=1S/C11H12IN3/c12-9-3-1-2-8(6-9)11-14-7-10(15-11)4-5-13/h1-3,6-7H,4-5,13H2,(H,14,15) | UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 610 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Cavia porcellus (domestic guinea pig)) | BDBM22863
(2-(3-Bromophenyl)histamine | 2-[2-(3-bromophenyl)-...)Show InChI InChI=1S/C11H12BrN3/c12-9-3-1-2-8(6-9)11-14-7-10(15-11)4-5-13/h1-3,6-7H,4-5,13H2,(H,14,15) | UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
Similars
| Article PubMed
| 700 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM86173
(2-(3-Iodophenyl)histamine)Show InChI InChI=1S/C11H12IN3/c12-9-3-1-2-8(6-9)11-14-7-10(15-11)4-5-13/h1-3,6-7H,4-5,13H2,(H,14,15) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
| Article PubMed
| 1.76E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM86172
(2-(3-Chlorophenyl)histamine)Show InChI InChI=1S/C11H12ClN3/c12-9-3-1-2-8(6-9)11-14-7-10(15-11)4-5-13/h1-3,6-7H,4-5,13H2,(H,14,15) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
Similars
| Article PubMed
| 1.78E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM7966
(2-(1H-imidazol-4-yl)ethan-1-amine | CHEMBL544208 |...)Show InChI InChI=1S/C5H9N3/c6-2-1-5-3-7-4-8-5/h3-4H,1-2,6H2,(H,7,8) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| DrugBank Article PubMed
| 2.06E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Homo sapiens (Human)) | BDBM22863
(2-(3-Bromophenyl)histamine | 2-[2-(3-bromophenyl)-...)Show InChI InChI=1S/C11H12BrN3/c12-9-3-1-2-8(6-9)11-14-7-10(15-11)4-5-13/h1-3,6-7H,4-5,13H2,(H,14,15) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
PC cid PC sid UniChem
Similars
| Article PubMed
| 2.22E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Cavia porcellus (domestic guinea pig)) | BDBM7966
(2-(1H-imidazol-4-yl)ethan-1-amine | CHEMBL544208 |...)Show InChI InChI=1S/C5H9N3/c6-2-1-5-3-7-4-8-5/h3-4H,1-2,6H2,(H,7,8) | UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| 4.65E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Histamine H1 receptor
(Cavia porcellus (domestic guinea pig)) | BDBM22866
(2-(1,3-thiazol-2-yl)ethan-1-amine | 2-(2-Thiazolyl...)Show InChI InChI=1S/C5H8N2S/c6-2-1-5-7-3-4-8-5/h3-4H,1-2,6H2 | UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
MCE KEGG PC cid PC sid UniChem
Patents
| Article PubMed
| 8.49E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Kansas
Curated by PDSP Ki Database
| |
J Pharmacol Exp Ther 305: 1104-15 (2003)
Article DOI: 10.1124/jpet.103.049619 BindingDB Entry DOI: 10.7270/Q2HM5708 |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50300863
(CHEMBL568011 | N-(3-(1H-Benzo[d]imidazol-2-yl)-4-c...)Show SMILES COc1cc(cc(OC)c1OC)C(=O)Nc1ccc(Cl)c(c1)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C23H20ClN3O4/c1-29-19-10-13(11-20(30-2)21(19)31-3)23(28)25-14-8-9-16(24)15(12-14)22-26-17-6-4-5-7-18(17)27-22/h4-12H,1-3H3,(H,25,28)(H,26,27) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 79.8 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leipzig
Curated by ChEMBL
| Assay Description Inhibition of SHH in mouse Shh-Light2 cells after 48 hrs by Gli1 reporter gene assay in presence of SAG |
Bioorg Med Chem 17: 4943-54 (2009)
Article DOI: 10.1016/j.bmc.2009.06.008 BindingDB Entry DOI: 10.7270/Q2SJ1KPN |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50249489
(CHEMBL514344 | N-(3-(1H-Benzo[d]imidazol-2-yl)-4-c...)Show SMILES CCOc1cc(cc(OCC)c1OCC)C(=O)Nc1ccc(Cl)c(c1)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C26H26ClN3O4/c1-4-32-22-13-16(14-23(33-5-2)24(22)34-6-3)26(31)28-17-11-12-19(27)18(15-17)25-29-20-9-7-8-10-21(20)30-25/h7-15H,4-6H2,1-3H3,(H,28,31)(H,29,30) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 97.9 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leipzig
Curated by ChEMBL
| Assay Description Inhibition of SHH in mouse Shh-Light2 cells after 48 hrs by Gli1 reporter gene assay in presence of SAG |
Bioorg Med Chem 17: 4943-54 (2009)
Article DOI: 10.1016/j.bmc.2009.06.008 BindingDB Entry DOI: 10.7270/Q2SJ1KPN |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50300862
(CHEMBL577049 | N-(3-(1H-Benzo[d]imidazol-2-yl)-4-c...)Show SMILES COc1ccc(cc1)C(=O)Nc1ccc(Cl)c(c1)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C21H16ClN3O2/c1-27-15-9-6-13(7-10-15)21(26)23-14-8-11-17(22)16(12-14)20-24-18-4-2-3-5-19(18)25-20/h2-12H,1H3,(H,23,26)(H,24,25) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 117 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leipzig
Curated by ChEMBL
| Assay Description Inhibition of SHH in mouse Shh-Light2 cells after 48 hrs by Gli1 reporter gene assay in presence of SAG |
Bioorg Med Chem 17: 4943-54 (2009)
Article DOI: 10.1016/j.bmc.2009.06.008 BindingDB Entry DOI: 10.7270/Q2SJ1KPN |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50300861
(CHEMBL567378 | N-(3-(1H-Benzo[d]imidazol-2-yl)-4-c...)Show SMILES FC(F)(F)c1cccc(c1)C(=O)Nc1ccc(Cl)c(c1)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C21H13ClF3N3O/c22-16-9-8-14(11-15(16)19-27-17-6-1-2-7-18(17)28-19)26-20(29)12-4-3-5-13(10-12)21(23,24)25/h1-11H,(H,26,29)(H,27,28) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 119 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leipzig
Curated by ChEMBL
| Assay Description Inhibition of SHH in mouse Shh-Light2 cells after 48 hrs by Gli1 reporter gene assay in presence of SAG |
Bioorg Med Chem 17: 4943-54 (2009)
Article DOI: 10.1016/j.bmc.2009.06.008 BindingDB Entry DOI: 10.7270/Q2SJ1KPN |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50300860
(CHEMBL579397 | N-(3-(1H-Benzo[d]imidazol-2-yl)-4-c...)Show SMILES Clc1ccc(NC(=O)c2ccccc2)cc1-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C20H14ClN3O/c21-16-11-10-14(22-20(25)13-6-2-1-3-7-13)12-15(16)19-23-17-8-4-5-9-18(17)24-19/h1-12H,(H,22,25)(H,23,24) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 163 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leipzig
Curated by ChEMBL
| Assay Description Inhibition of SHH in mouse Shh-Light2 cells after 48 hrs by Gli1 reporter gene assay in presence of SAG |
Bioorg Med Chem 17: 4943-54 (2009)
Article DOI: 10.1016/j.bmc.2009.06.008 BindingDB Entry DOI: 10.7270/Q2SJ1KPN |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50300859
(CHEMBL568022 | N-(3-(1H-Benzo[d]imidazol-2-yl)-4-c...)Show SMILES Clc1ccc(NC(=O)c2ccc(cc2)C#N)cc1-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C21H13ClN4O/c22-17-10-9-15(24-21(27)14-7-5-13(12-23)6-8-14)11-16(17)20-25-18-3-1-2-4-19(18)26-20/h1-11H,(H,24,27)(H,25,26) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 185 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leipzig
Curated by ChEMBL
| Assay Description Inhibition of SHH in mouse Shh-Light2 cells after 48 hrs by Gli1 reporter gene assay in presence of SAG |
Bioorg Med Chem 17: 4943-54 (2009)
Article DOI: 10.1016/j.bmc.2009.06.008 BindingDB Entry DOI: 10.7270/Q2SJ1KPN |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50300858
(CHEMBL584688 | N-(3-(1H-Benzo[d]imidazol-2-yl)-4-c...)Show SMILES CN(C)c1ccc(cc1)C(=O)Nc1ccc(Cl)c(c1)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C22H19ClN4O/c1-27(2)16-10-7-14(8-11-16)22(28)24-15-9-12-18(23)17(13-15)21-25-19-5-3-4-6-20(19)26-21/h3-13H,1-2H3,(H,24,28)(H,25,26) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leipzig
Curated by ChEMBL
| Assay Description Inhibition of SHH in mouse Shh-Light2 cells after 48 hrs by Gli1 reporter gene assay in presence of SAG |
Bioorg Med Chem 17: 4943-54 (2009)
Article DOI: 10.1016/j.bmc.2009.06.008 BindingDB Entry DOI: 10.7270/Q2SJ1KPN |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50300857
(CHEMBL565554 | N-(3-(1H-Benzo[d]imidazol-2-yl)-4-c...)Show SMILES Clc1ccc(cc1)C(=O)Nc1ccc(Cl)c(c1)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C20H13Cl2N3O/c21-13-7-5-12(6-8-13)20(26)23-14-9-10-16(22)15(11-14)19-24-17-3-1-2-4-18(17)25-19/h1-11H,(H,23,26)(H,24,25) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 224 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leipzig
Curated by ChEMBL
| Assay Description Inhibition of SHH in mouse Shh-Light2 cells after 48 hrs by Gli1 reporter gene assay in presence of SAG |
Bioorg Med Chem 17: 4943-54 (2009)
Article DOI: 10.1016/j.bmc.2009.06.008 BindingDB Entry DOI: 10.7270/Q2SJ1KPN |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50300856
(CHEMBL583230 | N-(3-(1H-Benzo[d]imidazol-2-yl)-4-c...)Show SMILES Fc1ccc(cc1)C(=O)Nc1ccc(Cl)c(c1)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C20H13ClFN3O/c21-16-10-9-14(23-20(26)12-5-7-13(22)8-6-12)11-15(16)19-24-17-3-1-2-4-18(17)25-19/h1-11H,(H,23,26)(H,24,25) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 251 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leipzig
Curated by ChEMBL
| Assay Description Inhibition of SHH in mouse Shh-Light2 cells after 48 hrs by Gli1 reporter gene assay in presence of SAG |
Bioorg Med Chem 17: 4943-54 (2009)
Article DOI: 10.1016/j.bmc.2009.06.008 BindingDB Entry DOI: 10.7270/Q2SJ1KPN |
More data for this Ligand-Target Pair | |
Prostaglandin G/H synthase 2
(Homo sapiens (Human)) | BDBM50276581
((+/-)-wiedendiol B | CHEMBL456619)Show SMILES COc1ccc(O)c(O)c1\C=C1/[C@@H](C)CC[C@H]2C(C)(C)CCC[C@]12C |r| Show InChI InChI=1S/C22H32O3/c1-14-7-10-19-21(2,3)11-6-12-22(19,4)16(14)13-15-18(25-5)9-8-17(23)20(15)24/h8-9,13-14,19,23-24H,6-7,10-12H2,1-5H3/b16-13+/t14-,19-,22+/m0/s1 | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 700 | n/a | n/a | n/a | n/a | n/a | n/a |
Universität Bayreuth
Curated by ChEMBL
| Assay Description Inhibition of COX2 (unknown origin) |
Bioorg Med Chem 17: 1422-7 (2009)
Article DOI: 10.1016/j.bmc.2009.01.028 BindingDB Entry DOI: 10.7270/Q25B02BX |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50300855
(CHEMBL578143 | N-(3-(1H-Benzo[d]imidazol-2-yl)-4-c...)Show SMILES COc1ccccc1C(=O)Nc1ccc(Cl)c(c1)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C21H16ClN3O2/c1-27-19-9-5-2-6-14(19)21(26)23-13-10-11-16(22)15(12-13)20-24-17-7-3-4-8-18(17)25-20/h2-12H,1H3,(H,23,26)(H,24,25) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 876 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leipzig
Curated by ChEMBL
| Assay Description Inhibition of SHH in mouse Shh-Light2 cells after 48 hrs by Gli1 reporter gene assay in presence of SAG |
Bioorg Med Chem 17: 4943-54 (2009)
Article DOI: 10.1016/j.bmc.2009.06.008 BindingDB Entry DOI: 10.7270/Q2SJ1KPN |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50232973
(CHEMBL254129 | CYCLOPAMINE)Show SMILES C[C@@H]1[C@@H]2NC[C@@H](C)C[C@H]2O[C@]11CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC2=C1C |r,c:32,t:18| Show InChI InChI=1S/C27H41NO2/c1-15-11-24-25(28-14-15)17(3)27(30-24)10-8-20-21-6-5-18-12-19(29)7-9-26(18,4)23(21)13-22(20)16(27)2/h5,15,17,19-21,23-25,28-29H,6-14H2,1-4H3/t15-,17+,19-,20-,21-,23-,24+,25-,26-,27-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 1.31E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leipzig
Curated by ChEMBL
| Assay Description Inhibition of SHH in mouse Shh-Light2 cells after 48 hrs by Gli1 reporter gene assay in presence of SAG |
Bioorg Med Chem 17: 4943-54 (2009)
Article DOI: 10.1016/j.bmc.2009.06.008 BindingDB Entry DOI: 10.7270/Q2SJ1KPN |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50300854
(CHEMBL583231 | N-(3-(1H-Benzo[d]imidazol-2-yl)phen...)Show SMILES CCOc1cc(cc(OCC)c1OCC)C(=O)Nc1cccc(c1)-c1nc2ccccc2[nH]1 Show InChI InChI=1S/C26H27N3O4/c1-4-31-22-15-18(16-23(32-5-2)24(22)33-6-3)26(30)27-19-11-9-10-17(14-19)25-28-20-12-7-8-13-21(20)29-25/h7-16H,4-6H2,1-3H3,(H,27,30)(H,28,29) | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1.33E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Leipzig
Curated by ChEMBL
| Assay Description Inhibition of SHH in mouse Shh-Light2 cells after 48 hrs by Gli1 reporter gene assay in presence of SAG |
Bioorg Med Chem 17: 4943-54 (2009)
Article DOI: 10.1016/j.bmc.2009.06.008 BindingDB Entry DOI: 10.7270/Q2SJ1KPN |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50393847
(CHEMBL2160033)Show SMILES CN[C@H]1CC[C@H](CC1)N(Cc1cccc(c1)-c1ccncc1)C(=O)c1sc2ccccc2c1Cl |r,wU:2.1,5.8,(-3.86,-29.42,;-2.31,-29.42,;-1.55,-28.08,;-2.31,-26.75,;-1.55,-25.42,;-.01,-25.42,;.77,-26.75,;-.01,-28.08,;.77,-24.08,;-.01,-22.75,;-1.55,-22.75,;-2.31,-21.41,;-3.86,-21.41,;-4.63,-22.75,;-3.86,-24.08,;-2.31,-24.08,;-4.63,-25.42,;-6.17,-25.42,;-6.94,-26.75,;-6.17,-28.08,;-4.63,-28.08,;-3.86,-26.75,;2.31,-24.08,;3.08,-22.75,;3.08,-25.42,;2.47,-26.84,;3.65,-27.84,;3.67,-29.38,;5.02,-30.13,;6.33,-29.33,;6.31,-27.79,;4.96,-27.05,;4.62,-25.55,;5.62,-24.38,)| Show InChI InChI=1S/C28H28ClN3OS/c1-30-22-9-11-23(12-10-22)32(28(33)27-26(29)24-7-2-3-8-25(24)34-27)18-19-5-4-6-21(17-19)20-13-15-31-16-14-20/h2-8,13-17,22-23,30H,9-12,18H2,1H3/t22-,23+ | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 61.8 | n/a | n/a | n/a | n/a |
Universit£t Leipzig
Curated by ChEMBL
| Assay Description Activation of Shh pathway in mouse Shh-Light II cells assessed as induction of gli1 expression after 48 hrs by renilla luminescence assay |
Bioorg Med Chem 20: 6465-81 (2012)
Article DOI: 10.1016/j.bmc.2012.08.026 BindingDB Entry DOI: 10.7270/Q24Q7W3V |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50393848
(CHEMBL2160032)Show SMILES CN[C@H]1CC[C@@H](CC1)N(Cc1cccc(c1)-c1ccncc1)C(=O)c1ccc(o1)-c1ccccc1 |r,wU:2.1,wD:5.8,(24.16,-17.39,;25.49,-16.62,;25.49,-15.08,;24.16,-14.32,;24.16,-12.78,;25.49,-12.01,;26.83,-12.78,;26.83,-14.32,;25.49,-10.47,;24.16,-9.7,;22.83,-10.47,;21.5,-9.7,;20.16,-10.47,;20.16,-12.01,;21.5,-12.78,;22.83,-12.01,;21.5,-14.32,;20.16,-15.08,;20.16,-16.62,;21.5,-17.39,;22.83,-16.62,;22.83,-15.08,;26.83,-9.7,;26.83,-8.16,;28.16,-10.47,;29.62,-9.99,;30.53,-11.22,;29.64,-12.48,;28.17,-12.01,;30.38,-13.82,;31.92,-13.86,;32.66,-15.21,;31.86,-16.52,;30.33,-16.49,;29.58,-15.14,)| Show InChI InChI=1S/C30H31N3O2/c1-31-26-10-12-27(13-11-26)33(21-22-6-5-9-25(20-22)23-16-18-32-19-17-23)30(34)29-15-14-28(35-29)24-7-3-2-4-8-24/h2-9,14-20,26-27,31H,10-13,21H2,1H3/t26-,27- | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 53.8 | n/a | n/a | n/a | n/a |
Universit£t Leipzig
Curated by ChEMBL
| Assay Description Activation of Shh pathway in mouse Shh-Light II cells assessed as induction of gli1 expression after 48 hrs by renilla luminescence assay |
Bioorg Med Chem 20: 6465-81 (2012)
Article DOI: 10.1016/j.bmc.2012.08.026 BindingDB Entry DOI: 10.7270/Q24Q7W3V |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50393849
(CHEMBL2160031)Show SMILES CN[C@H]1CC[C@@H](CC1)N(Cc1cccc(c1)-c1ccncc1)C(=O)c1sc2cccc(Cl)c2c1Cl |r,wU:2.1,wD:5.8,(-1.55,-17.08,;-.01,-17.08,;.76,-15.74,;-.01,-14.41,;.76,-13.08,;2.3,-13.08,;3.07,-14.41,;2.3,-15.74,;3.07,-11.75,;2.3,-10.42,;.76,-10.42,;-.01,-9.08,;-1.55,-9.08,;-2.32,-10.42,;-1.55,-11.75,;-.01,-11.75,;-2.32,-13.08,;-3.86,-13.08,;-4.63,-14.41,;-3.86,-15.74,;-2.32,-15.74,;-1.55,-14.41,;4.61,-11.75,;5.38,-10.42,;5.38,-13.08,;4.76,-14.49,;5.9,-15.51,;5.9,-17.05,;7.23,-17.83,;8.57,-17.05,;8.57,-15.51,;9.91,-14.75,;7.23,-14.75,;6.92,-13.24,;7.95,-12.1,)| Show InChI InChI=1S/C28H27Cl2N3OS/c1-31-21-8-10-22(11-9-21)33(17-18-4-2-5-20(16-18)19-12-14-32-15-13-19)28(34)27-26(30)25-23(29)6-3-7-24(25)35-27/h2-7,12-16,21-22,31H,8-11,17H2,1H3/t21-,22- | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 21.9 | n/a | n/a | n/a | n/a |
Universit£t Leipzig
Curated by ChEMBL
| Assay Description Activation of Shh pathway in mouse Shh-Light II cells assessed as induction of gli1 expression after 48 hrs by renilla luminescence assay |
Bioorg Med Chem 20: 6465-81 (2012)
Article DOI: 10.1016/j.bmc.2012.08.026 BindingDB Entry DOI: 10.7270/Q24Q7W3V |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50393850
(CHEMBL2160030)Show SMILES CN[C@H]1CC[C@H](CC1)N(Cc1cccc(c1)-c1ccncc1)C(=O)c1sc2cccc(Cl)c2c1Cl |r,wU:2.1,5.8,(19.69,-4.3,;21.23,-4.3,;22.01,-2.97,;21.23,-1.64,;22.01,-.31,;23.55,-.31,;24.31,-1.64,;23.55,-2.97,;24.31,1.03,;23.55,2.36,;22.01,2.36,;21.23,3.7,;19.69,3.7,;18.93,2.36,;19.69,1.03,;21.23,1.03,;18.93,-.31,;17.39,-.31,;16.61,-1.64,;17.39,-2.97,;18.93,-2.97,;19.69,-1.64,;25.85,1.03,;26.63,2.36,;26.63,-.31,;26,-1.72,;27.15,-2.73,;27.15,-4.27,;28.48,-5.05,;29.81,-4.27,;29.81,-2.73,;31.15,-1.97,;28.48,-1.97,;28.16,-.46,;29.19,.68,)| Show InChI InChI=1S/C28H27Cl2N3OS/c1-31-21-8-10-22(11-9-21)33(17-18-4-2-5-20(16-18)19-12-14-32-15-13-19)28(34)27-26(30)25-23(29)6-3-7-24(25)35-27/h2-7,12-16,21-22,31H,8-11,17H2,1H3/t21-,22+ | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 7.60 | n/a | n/a | n/a | n/a |
Universit£t Leipzig
Curated by ChEMBL
| Assay Description Activation of Shh pathway in mouse Shh-Light II cells assessed as induction of gli1 expression after 48 hrs by renilla luminescence assay |
Bioorg Med Chem 20: 6465-81 (2012)
Article DOI: 10.1016/j.bmc.2012.08.026 BindingDB Entry DOI: 10.7270/Q24Q7W3V |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50393851
(CHEMBL1221983)Show SMILES CN[C@H]1CC[C@@H](CC1)N(Cc1cccc(c1)-c1ccncc1)C(=O)c1sc2ccccc2c1Cl |r,wU:5.8,wD:2.1,(8.79,-24.79,;10.12,-24.01,;10.12,-22.47,;11.45,-21.7,;11.45,-20.15,;10.12,-19.4,;8.78,-20.17,;8.78,-21.7,;10.11,-17.86,;8.77,-17.1,;7.44,-17.87,;7.45,-19.42,;6.11,-20.19,;4.78,-19.43,;4.78,-17.88,;6.11,-17.11,;3.45,-17.12,;2.12,-17.89,;.78,-17.12,;.78,-15.57,;2.11,-14.8,;3.45,-15.57,;11.44,-17.08,;11.43,-15.54,;12.67,-18,;12.65,-19.54,;14.11,-20.02,;14.71,-21.43,;16.24,-21.62,;17.16,-20.38,;16.55,-18.97,;15.03,-18.79,;14.14,-17.54,;14.63,-16.08,)| Show InChI InChI=1S/C28H28ClN3OS/c1-30-22-9-11-23(12-10-22)32(28(33)27-26(29)24-7-2-3-8-25(24)34-27)18-19-5-4-6-21(17-19)20-13-15-31-16-14-20/h2-8,13-17,22-23,30H,9-12,18H2,1H3/t22-,23- | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid PDB UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 8.80 | n/a | n/a | n/a | n/a |
Universit£t Leipzig
Curated by ChEMBL
| Assay Description Activation of Shh pathway in mouse Shh-Light II cells assessed as induction of gli1 expression after 48 hrs by renilla luminescence assay |
Bioorg Med Chem 20: 6465-81 (2012)
Article DOI: 10.1016/j.bmc.2012.08.026 BindingDB Entry DOI: 10.7270/Q24Q7W3V |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50393845
(CHEMBL2160035)Show SMILES CN[C@H]1CC[C@@H](CC1)N(Cc1cccc(c1)-c1ccncc1)C(=O)c1sc2cc(F)ccc2c1Cl |r,wU:2.1,wD:5.8,(-2.43,-42.98,;-1.11,-42.19,;-1.14,-40.65,;-2.49,-39.91,;-2.52,-38.37,;-1.2,-37.57,;.15,-38.32,;.17,-39.86,;-1.23,-36.03,;-2.57,-35.29,;-3.89,-36.08,;-5.24,-35.34,;-6.55,-36.14,;-6.53,-37.68,;-5.18,-38.42,;-3.86,-37.62,;-5.15,-39.95,;-6.47,-40.75,;-6.44,-42.28,;-5.09,-43.03,;-3.78,-42.24,;-3.8,-40.7,;.09,-35.24,;.06,-33.7,;1.43,-35.99,;1.46,-37.52,;2.92,-37.98,;3.57,-39.38,;5.1,-39.53,;5.74,-40.92,;5.99,-38.27,;5.34,-36.87,;3.81,-36.73,;2.89,-35.5,;3.35,-34.03,)| Show InChI InChI=1S/C28H27ClFN3OS/c1-31-22-6-8-23(9-7-22)33(17-18-3-2-4-20(15-18)19-11-13-32-14-12-19)28(34)27-26(29)24-10-5-21(30)16-25(24)35-27/h2-5,10-16,22-23,31H,6-9,17H2,1H3/t22-,23- | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 176 | n/a | n/a | n/a | n/a |
Universit£t Leipzig
Curated by ChEMBL
| Assay Description Activation of Shh pathway in mouse Shh-Light II cells assessed as induction of gli1 expression after 48 hrs by renilla luminescence assay |
Bioorg Med Chem 20: 6465-81 (2012)
Article DOI: 10.1016/j.bmc.2012.08.026 BindingDB Entry DOI: 10.7270/Q24Q7W3V |
More data for this Ligand-Target Pair | |
Sonic hedgehog protein
(Mus musculus (Mouse)) | BDBM50393846
(CHEMBL2160034)Show SMILES CN[C@H]1CC[C@@H](CC1)N(Cc1cccc(c1)-c1ccncc1)C(=O)c1[nH]c2ccccc2c1Cl |r,wU:2.1,wD:5.8,(19.73,-28.37,;21.27,-28.37,;22.04,-27.04,;21.27,-25.71,;22.04,-24.37,;23.58,-24.37,;24.36,-25.71,;23.58,-27.04,;24.36,-23.04,;23.58,-21.71,;22.04,-21.71,;21.27,-20.37,;19.73,-20.37,;18.96,-21.71,;19.73,-23.04,;21.27,-23.04,;18.96,-24.37,;17.42,-24.37,;16.65,-25.71,;17.42,-27.04,;18.96,-27.04,;19.73,-25.71,;25.9,-23.04,;26.66,-21.71,;26.66,-24.37,;26.04,-25.78,;27.19,-26.81,;27.19,-28.35,;28.52,-29.12,;29.85,-28.35,;29.85,-26.81,;28.52,-26.04,;28.2,-24.53,;29.23,-23.39,)| Show InChI InChI=1S/C28H29ClN4O/c1-30-22-9-11-23(12-10-22)33(28(34)27-26(29)24-7-2-3-8-25(24)32-27)18-19-5-4-6-21(17-19)20-13-15-31-16-14-20/h2-8,13-17,22-23,30,32H,9-12,18H2,1H3/t22-,23- | PDB
UniProtKB/SwissProt
GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | n/a | n/a | 118 | n/a | n/a | n/a | n/a |
Universit£t Leipzig
Curated by ChEMBL
| Assay Description Activation of Shh pathway in mouse Shh-Light II cells assessed as induction of gli1 expression after 48 hrs by renilla luminescence assay |
Bioorg Med Chem 20: 6465-81 (2012)
Article DOI: 10.1016/j.bmc.2012.08.026 BindingDB Entry DOI: 10.7270/Q24Q7W3V |
More data for this Ligand-Target Pair | |