Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | IGF1R | P08069 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | AXL | P30530 | 1/20 | 0.34 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 4/20 | 0.34 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | ERN1 | O75460 | 2/20 | 0.31 |
| ▸ | LCK | P06239 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.31 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.31 |
| ▸ | PRKDC | P78527 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25342040 | 0.95 | IGF1R (0.36) | CYP19A1IGF1RSRCAXLPTK2 | |
| SCHEMBL25341714 | 0.92 | CYP19A1 (0.37) | CYP19A1IGF1RSRCAXLPTK2 | |
| SCHEMBL3677774 | 0.90 | AKR1B1 (0.38) | CYP19A1IGF1RSRCAXLPTK2 | |
| SCHEMBL1637371 | 0.90 | IMPDH2 (0.37) | CYP19A1IGF1RSRCAXLPTK2 | |
| SCHEMBL4943759 | 0.84 | IMPDH2 (0.42) | CYP19A1IGF1RSRCAXLPTK2 | |
| SCHEMBL20100074 | 0.79 | IMPDH2 (0.30) | IMPDH2 | |
| SCHEMBL8924293 | 0.78 | IMPDH2 (0.43) | CYP19A1IGF1RSRCAXLPTK2 | |
| SCHEMBL14392685 | 0.78 | AKR1B1 (0.34) | IGF1RSRCAXLPTK2AURKB | |
| SCHEMBL10591154 | 0.76 | AKR1B1 (0.33) | IGF1RSRCAXLPTK2AURKB | |
| SCHEMBL22568074 | 0.75 | CA1 (0.38) | AKR1B1IMPDH2CA1CA2ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009042544-A1 | QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF | INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) | 2009-04-02 | — | — | WO | disclosed |
| EP-0503426-B1 | Quinone derivatives | EISAI CO LTD (JP) | 1996-12-27 | — | — | EP | disclosed |
| US-5329010-A | Unsaturated groups with heteroarylalkyl groups and carboxy derivatives | EISAI CO., LTD. (JP) | 1994-07-12 | — | — | US | disclosed |
| EP-0503426-A1 | Quinone derivatives | Eisai Co., Ltd. (JP) | 1992-09-16 | — | — | EP | disclosed |