Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 4/20 | 0.64 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.59 |
| ▸ | PKM | P14618 | 1/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | CCR6 | P51684 | 1/20 | 0.59 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 5/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 5/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL10863273 | 0.87 | MAPT (0.58) | DHODHGLO1KMT2ANPSR1MEN1 | |
| SCHEMBL5256107 | 0.86 | KDM4E (0.69) | DHODHGLO1KMT2ANPSR1MEN1 | |
| SCHEMBL5256103 | 0.86 | KDM4E (0.69) | DHODHGLO1KMT2ANPSR1MEN1 | |
| SCHEMBL537859 | 0.84 | DHODH (0.69) | DHODHGLO1KMT2ANPSR1MEN1 | |
| SCHEMBL7157263 | 0.84 | KMT2A (0.52) | DHODHGLO1KMT2ANPSR1MEN1 | |
| SCHEMBL7157266 | 0.84 | KMT2A (0.52) | DHODHGLO1KMT2ANPSR1MEN1 | |
| SCHEMBL1904632 | 0.81 | DHODH (0.73) | DHODHKMT2ANPSR1MEN1MAPT | |
| SCHEMBL4579095 | 0.81 | KMT2A (0.66) | GLO1KMT2ANPSR1MEN1NPC1 | |
| SCHEMBL10859666 | 0.81 | MAPT (0.61) | DHODHGLO1KMT2ANPSR1MEN1 | |
| SCHEMBL10988529 | 0.79 | DHODH (0.70) | DHODHKMT2ANPSR1MEN1MAPT |
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-2008093940-A1 | QUINOLINE DERIVATIVES AS CASPASE-3 INHIBITOR, PREPARATION PROCESS FOR THE SAME AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | YUNGJIN PHARMACEUTICAL CO., LTD. (KR) | 2008-08-07 | — | — | WO | disclosed |
| EP-0174832-A2 | Ethene derivatives | MAY & BAKER LIMITED (GB) | 1986-03-19 | — | — | EP | disclosed |
| US-4137227-A | BACTERICIDES | STERLING DRUG INC. (US) | 1979-01-30 | — | — | US | disclosed |