Reaction Details |
| Report a problem with these data |
Target | Cytochrome P450 1A1 |
---|
Ligand | BDBM50614380 |
---|
Substrate/Competitor | n/a |
---|
Meas. Tech. | ChEMBL_2296677 |
---|
IC50 | 300±n/a nM |
---|
Citation | Nandekar, PP; Khomane, K; Chaudhary, V; Rathod, VP; Borkar, RM; Bhandi, MM; Srinivas, R; Sangamwar, AT; Guchhait, SK; Bansal, AK Identification of leads for antiproliferative activity on MDA-MB-435 human breast cancer cells through pharmacophore and CYP1A1-mediated metabolism. Eur J Med Chem115:82-93 (2016) [PubMed] |
---|
More Info.: | Get all data from this article, Assay Method |
---|
|
Cytochrome P450 1A1 |
---|
Name: | Cytochrome P450 1A1 |
Synonyms: | CP1A1_HUMAN | CYP1A1 | CYPIA1 | Cytochrome P450 1A | Cytochrome P450 1A1 | Cytochrome P450 1A1 (CYP1A1) | P450 form 6 | P450-C | P450-P1 |
Type: | Protein |
Mol. Mass.: | 58177.23 |
Organism: | Homo sapiens (Human) |
Description: | P04798 |
Residue: | 512 |
Sequence: | MLFPISMSATEFLLASVIFCLVFWVIRASRPQVPKGLKNPPGPWGWPLIGHMLTLGKNPH
LALSRMSQQYGDVLQIRIGSTPVVVLSGLDTIRQALVRQGDDFKGRPDLYTFTLISNGQS
MSFSPDSGPVWAARRRLAQNGLKSFSIASDPASSTSCYLEEHVSKEAEVLISTLQELMAG
PGHFNPYRYVVVSVTNVICAICFGRRYDHNHQELLSLVNLNNNFGEVVGSGNPADFIPIL
RYLPNPSLNAFKDLNEKFYSFMQKMVKEHYKTFEKGHIRDITDSLIEHCQEKQLDENANV
QLSDEKIINIVLDLFGAGFDTVTTAISWSLMYLVMNPRVQRKIQEELDTVIGRSRRPRLS
DRSHLPYMEAFILETFRHSSFVPFTIPHSTTRDTSLKGFYIPKGRCVFVNQWQINHDQKL
WVNPSEFLPERFLTPDGAIDKVLSEKVIIFGMGKRKCIGETIARWEVFLFLAILLQRVEF
SVPLGVKVDMTPIYGLTMKHACCEHFQMQLRS
|
|
|
BDBM50614380 |
---|
n/a |
---|
Name | BDBM50614380 |
Synonyms: | CHEMBL5289750 |
Type | Small organic molecule |
Emp. Form. | C14H10F2N2 |
Mol. Mass. | 244.2394 |
SMILES | Nc1cc(ccc1F)-c1cc2cc(F)ccc2[nH]1 |
Structure |
|