Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.50 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.48 |
| ▸ | BAD | Q92934 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7942173 | 0.83 | ALDH1A1 (0.56) | ALDH1A1HTTMEN1KMT2APOLB | |
| SCHEMBL9877775 | 0.83 | CES2 (0.62) | ALDH1A1HTTMEN1KMT2APOLB | |
| SCHEMBL9877774 | 0.83 | CES2 (0.62) | ALDH1A1HTTMEN1KMT2APOLB | |
| SCHEMBL3069399 | 0.79 | AKR1C1 (0.61) | ALDH1A1HTTMEN1KMT2APOLB | |
| SCHEMBL6474719 | 0.79 | AKR1C1 (0.61) | ALDH1A1HTTMEN1KMT2APOLB | |
| SCHEMBL30493211 | 0.79 | ALDH1A1 (0.83) | ALDH1A1HTTMEN1KMT2APOLB | |
| SCHEMBL10367968 | 0.78 | ALDH1A1 (0.56) | ALDH1A1HTTMEN1KMT2AAKR1C1 | |
| SCHEMBL4771865 | 0.78 | CYP1A2 (0.52) | ALDH1A1MEN1KMT2APOLBAKR1C1 | |
| SCHEMBL4771867 | 0.78 | CYP1A2 (0.52) | ALDH1A1MEN1KMT2APOLBAKR1C1 | |
| SCHEMBL4768159 | 0.78 | CES2 (0.50) | ALDH1A1HTTMEN1KMT2APOLB |
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-0183994-B1 | TRICYCLIC PYRIDONE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1990-03-21 | — | — | EP | disclosed |