Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 4/20 | 0.49 |
| ▸ | NAMPT | P43490 | 2/20 | 0.41 |
| ▸ | VNN1 | O95497 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | PRMT5 | O14744 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15575673 | 0.85 | ITK (0.67) | ITKALDH1A1 | |
| SCHEMBL15576157 | 0.78 | OPRM1 (0.51) | ITKNAMPTVNN1ACHE | |
| SCHEMBL15575623 | 0.78 | PDE8B (0.46) | MAPTMEN1KMT2A | |
| SCHEMBL15575809 | 0.78 | PDE8B (0.46) | MAPTMEN1KMT2A | |
| SCHEMBL15575625 | 0.78 | PDE8B (0.46) | MAPTMEN1KMT2A | |
| SCHEMBL16987601 | 0.77 | ITK (0.56) | ITKALDH1A1MAPTKMT2A | |
| SCHEMBL15576084 | 0.75 | ITK (0.54) | ITK | |
| SCHEMBL15576083 | 0.75 | ITK (0.54) | ITK | |
| SCHEMBL845707 | 0.74 | PDE8B (0.45) | ALDH1A1MAPTACHEMEN1KMT2A | |
| SCHEMBL29030292 | 0.73 | POLB (0.44) | ALDH1A1MAPTMEN1KMT2APRMT5 |
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-2890691-A1 | BENZIMIDAZOLE DERIVATIVES AS ITK INHIBITORS | Principia Biopharma Inc. (US) | 2015-07-08 | — | — | EP | disclosed |
| WO-2014036016-A1 | BENZIMIDAZOLE DERIVATIVES AS ITK INHIBITORS | PRINCIPIA BIOPHARMA INC. (US) | 2014-03-06 | — | — | WO | disclosed |