Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 7/20 | 0.42 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.39 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3659618 | 0.93 | GAA (0.50) | NPSR1GAASMN1; SMN2MAPTTRPV1 | |
| SCHEMBL3661109 | 0.91 | MAPT (0.43) | NPSR1MAPTTRPV1MEN1CASP3 | |
| SCHEMBL3658031 | 0.87 | NR1H4 (0.47) | SMN1; SMN2MAPTRAB9ANPC1ALDH1A1 | |
| SCHEMBL3661070 | 0.83 | MAPT (0.47) | GAAMAPTRAB9ANPC1TSHR | |
| SCHEMBL3653242 | 0.81 | NR1H4 (0.45) | GAASMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL3659124 | 0.81 | NR1H4 (0.40) | NPSR1SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL3653916 | 0.81 | NR1H4 (0.45) | NPSR1GAASMN1; SMN2MAPTTSHR | |
| SCHEMBL3656516 | 0.80 | NR1H4 (0.46) | NPSR1GAASMN1; SMN2MAPTTSHR | |
| SCHEMBL3652179 | 0.79 | NR1H4 (0.53) | SMN1; SMN2MAPTRAB9ANPC1ALDH1A1 | |
| SCHEMBL4036796 | 0.79 | NPC1 (0.41) | SMN1; SMN2MAPTRAB9ANPC1POLB |
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-2225221-A2 | CARBOXYL- OR HYDROXYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVES | F. Hoffmann-La Roche AG (CH) | 2010-09-08 | — | — | EP | disclosed |
| WO-2009080555-A2 | CARBOXYL- OR HYDROXYL- SUBSTITUTED BENZIMIDAZOLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2009-07-02 | — | — | WO | disclosed |