Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | USP8 | P40818 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | MMP7 | P09237 | 1/20 | 0.32 |
| ▸ | MMP13 | P45452 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.32 |
| ▸ | TUBB | P07437 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5317820 | 1.00 | NPC1 (0.37) | NPC1RAB9AGAAMAPK1SMN1; SMN2 | |
| SCHEMBL4856100 | 0.86 | MAPK1 (0.38) | NPC1RAB9AGAAMAPK1SMN1; SMN2 | |
| SCHEMBL5320718 | 0.86 | MAPK8 (0.40) | ALDH1A1MEN1KMT2A | |
| SCHEMBL5321199 | 0.83 | CYP3A4 (0.35) | ALDH1A1USP8MEN1KMT2ACYP3A4 | |
| SCHEMBL5320440 | 0.78 | NPSR1 (0.40) | SMN1; SMN2ALDH1A1MEN1KMT2ACYP3A4 | |
| SCHEMBL14196714 | 0.73 | MAPK1 (0.39) | MAPK1NAMPT | |
| SCHEMBL5257488 | 0.71 | ACE (0.38) | NPC1RAB9ASMN1; SMN2USP8MMP1 | |
| SCHEMBL5317544 | 0.70 | NOTUM (0.41) | GAAMAPK1ALDH1A1MEN1KMT2A | |
| SCHEMBL14196720 | 0.69 | MAPK1 (0.38) | GAAMAPK1NAMPTALDH1A1USP8 | |
| SCHEMBL20237058 | 0.68 | NPC1 (0.48) | NPC1RAB9AMAPK1SMN1; SMN2NAMPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1537117-B1 | BENZOTRIAZABICYCLIC DERIVATIVES AND USE THEREOF AS BETA-LACTAMASE INHIBITORS AND ANTI-BACTERIAL AGENTS | AVENTIS PHARMA SA (FR) | 2007-01-17 | — | — | EP | disclosed |