Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.62 |
| ▸ | LCK | P06239 | 1/20 | 0.59 |
| ▸ | FYN | P06241 | 1/20 | 0.59 |
| ▸ | DAO | P14920 | 1/20 | 0.59 |
| ▸ | CDC25B | P30305 | 3/20 | 0.55 |
| ▸ | CDC25A | P30304 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.47 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Phthalic Acid SCHEMBL7268003 | 0.84 | LCK (0.57) | AKR1C3LCKFYNDAOCDC25B | |
| SCHEMBL11029525 | 0.83 | LCK (0.52) | AKR1C3LCKFYNDAOCDC25B | |
| Naphthoic Acid SCHEMBL4505176 | 0.82 | NR4A1 (0.62) | AKR1C3LCKFYNDAOCDC25B | |
| SCHEMBL838599 | 0.80 | LCK (0.61) | LCKFYNDAOHSD17B10ATM | |
| SCHEMBL31483529 | 0.80 | CES2 (0.48) | AKR1C3LCKFYNDAOALDH1A1 | |
| SCHEMBL17100175 | 0.80 | CES2 (0.48) | LCKFYNDAOHSD17B10ALDH1A1 | |
| SCHEMBL27357591 | 0.80 | C5AR1 (0.52) | LCKFYNDAOALDH1A1CES2 | |
| SCHEMBL2830034 | 0.80 | MAPT (0.61) | LCKFYNDAOHSD17B10ALDH1A1 | |
| 2-Benzoylbenzoic Acid SCHEMBL30296847 | 0.78 | AKR1C3 (1.00) | AKR1C3CDC25BCDC25AHSD17B10ATM | |
| 2-Benzoylbenzoic Acid SCHEMBL76332 | 0.78 | AKR1C3 (1.00) | AKR1C3CDC25BCDC25AHSD17B10ATM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5462941-A | 1-(cyclohexylalkylamino)-4-(phenyl, thienyl, or furyl) phthalazines; anti-platelet agglutination agents for treatment or prevention of cerebro- or cardiovascular disorders | MITSUBISHI CHEMICAL CORPORATION (JP) | 1995-10-31 | — | — | US | disclosed |
| EP-0534443-A1 | 3,6-Disubstituted pyridazine derivatives | Mitsubishi Chemical Corporation (JP) | 1993-03-31 | — | — | EP | disclosed |