Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 7/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 7/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.36 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.35 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.35 |
| ▸ | CTSA | P10619 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2141882 | 1.00 | CYP11B1 (0.39) | CYP11B1CYP11B2KDRBRD4CYP1A2 | |
| SCHEMBL2412501 | 0.96 | CYP11B1 (0.39) | CYP11B1CYP11B2KDRBRD4CYP1A2 | |
| SCHEMBL2412498 | 0.96 | CYP11B1 (0.39) | CYP11B1CYP11B2KDRBRD4CYP1A2 | |
| SCHEMBL316434 | 0.92 | MKNK1 (0.40) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL3399894 | 0.92 | MKNK1 (0.40) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL2142952 | 0.90 | MAP4K4 (0.42) | CYP11B1CYP11B2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL2139085 | 0.90 | CHRNB2 (0.36) | CYP11B1CYP11B2KDRMKNK1MKNK2 | |
| SCHEMBL2139089 | 0.90 | CHRNB2 (0.36) | CYP11B1CYP11B2KDRMKNK1MKNK2 | |
| SCHEMBL2411954 | 0.88 | S1PR1 (0.35) | CYP11B1CYP11B2KDRBRD4PIK3CG | |
| SCHEMBL2411957 | 0.88 | S1PR1 (0.35) | CYP11B1CYP11B2KDRBRD4PIK3CG |
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-1861411-A2 | NOVEL COMPOUNDS DERIVED FROM 5-THIOXYLOSE AND THERAPEUTIC USE THEREOF | LABORATOIRES FOURNIER S.A. (FR) | 2007-12-05 | — | — | EP | disclosed |
| WO-2006100413-A9 | NOVEL COMPOUNDS DERIVED FROM 5-THIOXYLOSE AND THERAPEUTIC USE THEREOF | FOURNIER LAB SA (FR) | 2007-10-18 | — | — | WO | disclosed |
| WO-2006100413-A2 | NOVEL COMPOUNDS DERIVED FROM 5-THIOXYLOSE AND THERAPEUTIC USE THEREOF | LABORATOIRES FOURNIER S.A. (FR) | 2006-09-28 | — | — | WO | disclosed |