Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MITF | O75030 | 1/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.39 |
| ▸ | STAT3 | P40763 | 1/20 | 0.39 |
| ▸ | STAT1 | P42224 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2549851 | 0.80 | ALDH1A1 (0.42) | ALDH1A1LMNANPSR1PKMPOLB | |
| SCHEMBL16144557 | 0.70 | KMT2A (0.57) | ALDH1A1LMNANPSR1POLBKMT2A | |
| SCHEMBL10280755 | 0.69 | PSIP1 (0.54) | ALDH1A1LMNANPSR1KMT2AHTT | |
| SCHEMBL11166475 | 0.68 | ALDH1A1 (0.53) | ALDH1A1LMNANPSR1POLBKMT2A | |
| Hydrochloric Acid SCHEMBL160719 | 0.68 | PSIP1 (0.53) | ALDH1A1LMNANPSR1KMT2AHTT | |
| SCHEMBL7874157 | 0.67 | KMT2A (0.71) | ALDH1A1LMNAPOLBKMT2AGAA | |
| SCHEMBL7874047 | 0.66 | KMT2A (0.53) | ALDH1A1LMNANPSR1POLBKMT2A | |
| SCHEMBL7870908 | 0.66 | ALDH1A1 (0.62) | ALDH1A1LMNANPSR1POLBKMT2A | |
| SCHEMBL7874068 | 0.66 | POLB (0.59) | ALDH1A1LMNAPOLBKMT2AMEN1 | |
| SCHEMBL28897130 | 0.66 | KMT2A (0.53) | ALDH1A1LMNANPSR1PKMPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011121309-A1 | PHENYL SULFONYL DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-10-06 | — | — | WO | disclosed |
| WO-2011121309-A1 | PHENYL SULFONYL DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-10-06 | — | — | WO | disclosed |