Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 5/20 | 0.61 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | MGAM | O43451 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
| ▸ | PCSK7 | Q16549 | 1/20 | 0.43 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.43 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8945418 | 0.87 | NQO1 (0.62) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL8945547 | 0.86 | NQO1 (0.55) | NQO1MCL1MEN1ABCB11ALDH1A1 | |
| SCHEMBL6957985 | 0.85 | NQO1 (0.60) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL8945691 | 0.85 | VKORC1 (0.52) | NQO1MCL1MEN1ABCB11ALDH1A1 | |
| SCHEMBL8945414 | 0.84 | NQO1 (0.53) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL8945266 | 0.79 | NQO1 (0.61) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL3275885 | 0.79 | NQO1 (0.76) | NQO1MAOAMGAMMEN1ABCB11 | |
| SCHEMBL8945405 | 0.76 | VKORC1 (0.50) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL8934490 | 0.76 | VKORC1 (0.68) | NQO1MEN1ABCB11ALDH1A1LMNA | |
| SCHEMBL8945572 | 0.76 | NQO1 (0.55) | NQO1MEN1ABCB11ALDH1A1LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996031206-A2 | FLAVONES AND COUMARINS AS AGENTS FOR THE TREATMENT OF ATHEROSCLEROSIS | WARNER-LAMBERT COMPANY (US) | 1996-10-10 | — | — | WO | claimed |
| WO-1996031206-A2 | FLAVONES AND COUMARINS AS AGENTS FOR THE TREATMENT OF ATHEROSCLEROSIS | WARNER-LAMBERT COMPANY (US) | 1996-10-10 | — | — | WO | disclosed |
| US-5510375-A | VIRICIDES TREATING INFECTION CAUSED BY HUMAN IMMUNODEFICIENCY VIRUS AND AIDS | WARNER-LAMBERT COMPANY (US) | 1996-04-23 | — | — | US | disclosed |