Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.57 |
| ▸ | ATM | Q13315 | 2/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | APP | P05067 | 1/20 | 0.52 |
| ▸ | HTR1A | P08908 | 1/20 | 0.51 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.51 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.51 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.51 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL22997885 | 1.00 | MEN1 (0.57) | MEN1KMT2AATMSMN1; SMN2GAA | |
| SCHEMBL3272392 | 0.92 | SLC2A1 (0.54) | MEN1KMT2AATMSMN1; SMN2KDM4E | |
| Hydrochloric Acid SCHEMBL5628566 | 0.91 | SLC2A1 (0.52) | MEN1KMT2AATMSMN1; SMN2KDM4E | |
| Toluene SCHEMBL29239493 | 0.88 | TAAR1 (0.51) | MEN1KMT2AATMMAPTKDM4E | |
| SCHEMBL2845384 | 0.87 | KDM4E (0.61) | MEN1KMT2AATMSMN1; SMN2GAA | |
| SCHEMBL30028263 | 0.87 | KDM4E (0.68) | MEN1KMT2AATMKDM4EAPP | |
| SCHEMBL2742565 | 0.87 | KDM4E (0.68) | KMT2AATMSMN1; SMN2KDM4ELMNA | |
| SCHEMBL67744 | 0.87 | KDM4E (0.68) | MEN1KMT2AATMKDM4EAPP | |
| Hydrochloric Acid SCHEMBL17821823 | 0.85 | KDM4E (0.66) | MEN1KMT2AATMSMN1; SMN2KDM4E | |
| Hydrochloric Acid SCHEMBL1298567 | 0.85 | KDM4E (0.66) | MEN1KMT2AATMKDM4ELMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001055117-A1 | NOVEL ISOQUINOLINE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | LES LABORATOIRES SERVIER (FR) | 2001-08-02 | — | — | WO | disclosed |