Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 3/20 | 0.45 |
| ▸ | LCK | P06239 | 2/20 | 0.45 |
| ▸ | TXK | P42681 | 2/20 | 0.45 |
| ▸ | SYK | P43405 | 2/20 | 0.45 |
| ▸ | AURKA | O14965 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | PRMT3 | O60678 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1623119 | 0.86 | ITK (0.47) | ITKLCKTXKSYKHPGD | |
| SCHEMBL2898022 | 0.83 | ITK (0.47) | ITKLCKTXKSYKAURKA | |
| SCHEMBL2898574 | 0.81 | ITK (0.45) | ITKLCKTXKSYKAURKA | |
| SCHEMBL2903568 | 0.77 | ITK (0.43) | ITKLCKTXKSYKHPGD | |
| SCHEMBL27645971 | 0.77 | ITK (0.62) | ITKLCKTXKSYKAURKA | |
| SCHEMBL2903516 | 0.76 | ITK (0.47) | ITKLCKTXKSYKAURKA | |
| SCHEMBL2898497 | 0.76 | ITK (0.59) | ITKLCKTXKSYKAURKA | |
| SCHEMBL13869803 | 0.69 | ITK (0.60) | ITKLCKTXKSYKALDH1A1 | |
| SCHEMBL1622884 | 0.69 | ITK (0.50) | ITKLCKTXKSYKHPGD | |
| SCHEMBL27667096 | 0.68 | ITK (0.64) | 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 |