Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 5/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.47 |
| ▸ | CRHBP | P24387 | 2/20 | 0.47 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.44 |
| ▸ | MITF | O75030 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | TNF | P01375 | 1/20 | 0.41 |
| ▸ | BCL6 | P41182 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8671420 | 0.83 | ALDH1A1 (0.52) | MAPTKDM4EHSP90AA1CRHBPCRHR2 | |
| SCHEMBL16239187 | 0.79 | HSP90AA1 (0.49) | MAPTKDM4EHSP90AA1CRHBPCRHR2 | |
| SCHEMBL9670567 | 0.79 | ALDH1A1 (0.53) | MAPTKDM4EHSP90AA1CRHBPCRHR2 | |
| SCHEMBL27972555 | 0.79 | NCEH1 (0.45) | MAPTKDM4EHSP90AA1CRHBPCRHR2 | |
| SCHEMBL19157082 | 0.79 | MAPT (0.51) | TOP2AMAPTKDM4ECRHBPCRHR2 | |
| SCHEMBL13728019 | 0.79 | MAPT (0.48) | TOP2AMAPTKDM4ECRHBPCRHR2 | |
| SCHEMBL17819091 | 0.78 | CNR1 (0.52) | MAPTKDM4EHSP90AA1CRHBPCRHR2 | |
| SCHEMBL16238997 | 0.75 | CDC25B (0.53) | MAPTKDM4EHSP90AA1CRHBPCRHR2 | |
| SCHEMBL29908861 | 0.75 | BCHE (0.46) | MAPTHSP90AA1CRHBPCRHR2TSHR | |
| SCHEMBL8609981 | 0.75 | HSP90AA1 (0.49) | MAPTKDM4EHSP90AA1CRHBPCRHR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0799224-B1 | QUINOXALINES AND DRUGS PREPARED THEREFROM | BASF AG (DE) | 2002-04-17 | — | — | EP | disclosed |
| US-5849743-A | Quinoxalines and drugs prepared therefrom | BASF AKTIENGESELLSCHAFT (DE) | 1998-12-15 | — | — | US | disclosed |
| WO-1996019476-A1 | NOVEL QUINOXALINES AND DRUGS PREPARED THEREFROM | BASF AKTIENGESELLSCHAFT (DE) | 1996-06-27 | — | — | WO | disclosed |