Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 7/20 | 0.42 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.42 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | SQLE | Q14534 | 3/20 | 0.37 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.34 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.34 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.34 |
| ▸ | PTPRC | P08575 | 1/20 | 0.34 |
| ▸ | LPL | P06858 | 1/20 | 0.34 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4169939 | 0.81 | CYP2A6 (0.42) | CYP2A6CYP2B6CYP2E1KCNH2SQLE | |
| SCHEMBL9454086 | 0.81 | CYP2A6 (0.42) | CYP2A6CYP2B6CYP2E1KCNH2SQLE | |
| SCHEMBL7393295 | 0.81 | KCNH2 (0.44) | CYP2A6CYP2B6CYP2E1KCNH2SQLE | |
| SCHEMBL6375451 | 0.76 | CYP11B1 (0.49) | CYP2A6CYP2B6CYP2E1CYP11B1CYP11B2 | |
| SCHEMBL9174018 | 0.74 | SQLE (0.63) | SQLEPRMT6 | |
| SCHEMBL9256414 | 0.72 | CYP2A6 (0.38) | CYP2A6CYP2B6CYP2E1KCNH2SQLE | |
| SCHEMBL22734782 | 0.71 | CYP2A6 (0.48) | CYP2A6CYP2B6CYP2E1KCNH2PRMT6 | |
| SCHEMBL2125063 | 0.71 | CYP2A6 (0.72) | CYP2A6CYP2B6CYP2E1KCNH2PRMT6 | |
| SCHEMBL7445908 | 0.69 | CYP17A1 (0.56) | CYP2A6CYP2B6CYP2E1KCNH2PRMT6 | |
| SCHEMBL4244869 | 0.69 | CYP2A6 (0.48) | CYP2A6CYP2B6CYP2E1KCNH2PRMT6 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0421302-B1 | Process for producing enyne derivatives | BANYU PHARMA CO LTD (JP) | 1996-06-26 | — | — | EP | disclosed |
| US-5440049-A | Process for producing enyne derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1995-08-08 | — | — | US | disclosed |
| US-5436354-A | Intermediates for producing enyne derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1995-07-25 | — | — | US | disclosed |
| EP-0645369-A2 | Process for producing enyne Derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1995-03-29 | — | — | EP | disclosed |
| US-5359091-A | Intermediates for producing enyne derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1994-10-25 | — | — | US | disclosed |
| US-5296612-A | Process for producing enyne derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1994-03-22 | — | — | US | disclosed |
| US-5231183-A | Process for producing enyne derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1993-07-27 | — | — | US | disclosed |
| EP-0421302-A2 | Process for producing enyne derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1991-04-10 | — | — | EP | disclosed |