Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | PTAFR | P25105 | 1/20 | 0.30 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.30 |
| ▸ | PIM1 | P11309 | 1/20 | 0.30 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9137525 | 0.67 | — | — | |
| SCHEMBL13258567 | 0.61 | NISCH (0.36) | KMT2ANPC1MAPTRAB9AGFER | |
| SCHEMBL21697025 | 0.61 | PDE3B (0.33) | KMT2ANPC1MAPTRAB9ASMN1; SMN2 | |
| Water SCHEMBL3680095 | 0.58 | ACHE (0.67) | ALDH1A1HPGDCYP2A6HSD17B10 | |
| Water SCHEMBL3763584 | 0.58 | ACHE (0.67) | ALDH1A1HPGDCYP2A6HSD17B10 | |
| P-Xylene SCHEMBL1443687 | 0.56 | ACHE (0.61) | KMT2ANPC1MAPTRAB9AALDH1A1 | |
| SCHEMBL197731 | 0.55 | ACHE (0.73) | ALDH1A1HPGDHSD17B10 | |
| SCHEMBL18661495 | 0.55 | ACHE (0.73) | ALDH1A1HPGDHSD17B10 | |
| SCHEMBL3287696 | 0.55 | ACHE (0.73) | ALDH1A1HPGDHSD17B10 | |
| P-Xylene SCHEMBL18229935 | 0.55 | — | — |
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-2247586-A1 | 2-AZA-BICYCLO[2.2.1]HEPTANE DERIVATIVES | Actelion Pharmaceuticals Ltd. (CH) | 2010-11-10 | — | — | EP | disclosed |
| WO-2009104155-A1 | 2-AZA-BICYCLO[2.2.1]HEPTANE DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2009-08-27 | — | — | WO | disclosed |