Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 5/20 | 0.43 |
| ▸ | LCK | P06239 | 2/20 | 0.43 |
| ▸ | TXK | P42681 | 2/20 | 0.43 |
| ▸ | SYK | P43405 | 2/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.41 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | F3 | P13726 | 1/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TTK | P33981 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2898022 | 0.93 | ITK (0.47) | ITKLCKTXKSYKPDGFRB | |
| SCHEMBL1627170 | 0.85 | NPC1 (0.48) | ITKLCKTXKSYKSMN1; SMN2 | |
| SCHEMBL1622884 | 0.80 | ITK (0.50) | ITKLCKTXKSYKSMN1; SMN2 | |
| SCHEMBL2902831 | 0.77 | ITK (0.45) | ITKLCKTXKSYKSMN1; SMN2 | |
| SCHEMBL2903516 | 0.73 | ITK (0.47) | ITKLCKTXKSYKPDGFRB | |
| SCHEMBL27645971 | 0.71 | ITK (0.62) | ITKLCKTXKSYKPDGFRB | |
| SCHEMBL2898497 | 0.71 | ITK (0.59) | ITKLCKTXKSYKPDGFRB | |
| SCHEMBL27645976 | 0.70 | ITK (0.54) | ITKLCKTXKSYK | |
| SCHEMBL1620556 | 0.69 | ITK (0.51) | ITKLCKTXKSYKSMN1; SMN2 | |
| SCHEMBL1622468 | 0.69 | ITK (0.57) | ITKLCKTXKSYK |
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-1682553-B1 | THIENOPYRAZOLES | AVENTIS PHARMA INC (US) | 2010-05-19 | — | — | EP | claimed |