Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TPH1 | P17752 | 9/20 | 0.64 |
| ▸ | TPH2 | Q8IWU9 | 9/20 | 0.64 |
| ▸ | BRAF | P15056 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.55 |
| ▸ | USP2 | O75604 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | CXCL8 | P10145 | 2/20 | 0.54 |
| ▸ | NOD2 | Q9HC29 | 2/20 | 0.54 |
| ▸ | NOD1 | Q9Y239 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | TNF | P01375 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | G6PD | P11413 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.54 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL18036490 | 0.78 | TPH2 (1.00) | TPH1TPH2MEN1KMT2A | |
| SCHEMBL19874715 | 0.77 | TPH2 (0.82) | TPH1TPH2BRAFMAPK1USP2 | |
| SCHEMBL18036502 | 0.77 | TPH2 (1.00) | TPH1TPH2BRAFMAPK1USP2 | |
| SCHEMBL6348692 | 0.75 | BRAF (0.72) | TPH1TPH2BRAFMAPK1ALDH1A1 | |
| SCHEMBL555082 | 0.75 | BRAF (0.72) | TPH1TPH2BRAFMAPK1ALDH1A1 | |
| SCHEMBL4667126 | 0.74 | RECQL (0.76) | BRAFMAPK1USP2ALDH1A1L3MBTL1 | |
| SCHEMBL16028236 | 0.73 | ATM (0.67) | BRAFMAPK1USP2ALDH1A1NOD2 | |
| SCHEMBL18036499 | 0.70 | TPH2 (1.00) | TPH1TPH2BRAFMAPK1USP2 | |
| SCHEMBL16028495 | 0.70 | TSHR (0.67) | BRAFMAPK1USP2ALDH1A1CXCL8 | |
| SCHEMBL16076250 | 0.69 | ATM (0.62) | BRAFMAPK1USP2ALDH1A1NOD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3061761-A1 | Xanthine derivatives, their use as a medicament, and pharmaceutical preparations comprising the same | Max-Delbrück-Centrum für Molekulare Medizin (DE) | 2016-08-31 | — | — | EP | disclosed |
| EP-3061761-A1 | Xanthine derivatives, their use as a medicament, and pharmaceutical preparations comprising the same | Max-Delbrück-Centrum für Molekulare Medizin (DE) | 2016-08-31 | — | — | EP | disclosed |