Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 3/20 | 0.39 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | APAF1 | O14727 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | SRC | P12931 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8749590 | 0.85 | ALDH1A1 (0.46) | KMT2AALDH1A1L3MBTL1TSHRNR1H2 | |
| SCHEMBL6120907 | 0.85 | ALDH1A1 (0.46) | KMT2AALDH1A1L3MBTL1TSHRNR1H2 | |
| SCHEMBL5255513 | 0.83 | CASR (0.43) | KMT2AALDH1A1L3MBTL1TSHRNR1H2 | |
| SCHEMBL18586587 | 0.81 | CYP2D6 (0.43) | ALDH1A1TSHRNR1H2NR1H3NR4A2 | |
| SCHEMBL4693729 | 0.80 | LMNA (0.39) | KMT2AALDH1A1L3MBTL1TSHRSMN1; SMN2 | |
| SCHEMBL19772673 | 0.78 | KMT2A (0.47) | KMT2AALDH1A1L3MBTL1TSHRROCK2 | |
| SCHEMBL20348009 | 0.78 | KMT2A (0.47) | KMT2AALDH1A1L3MBTL1TSHRROCK2 | |
| SCHEMBL17702833 | 0.78 | KMT2A (0.47) | KMT2AALDH1A1TSHRROCK2NR4A2 | |
| SCHEMBL18931320 | 0.74 | KMT2A (0.43) | KMT2AALDH1A1L3MBTL1TSHRNR1H2 | |
| SCHEMBL5185704 | 0.73 | KMT2A (0.43) | KMT2AL3MBTL1NR1H2NR1H3 |
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-1798231-A2 | Intermediate products for the preparation of antibacterial compounds | NOVEXEL (FR) | 2007-06-20 | — | — | EP | disclosed |
| EP-1399444-B1 | NOVEL HETEROCYCLIC COMPOUNDS, METHOD FOR PREPARING SAME AND USE THEREOF AS MEDICINES, IN PARTICULAR AS ANTI-BACTERIAL AGENTS | NOVEXEL (FR) | 2007-04-11 | — | — | EP | disclosed |