Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 7/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL31246136 | 0.84 | CA12 (0.44) | TDP1CA1CA2CA12CA9 | |
| SCHEMBL16690694 | 0.84 | TDP1 (0.47) | TDP1CA1CA2CA12CA9 | |
| SCHEMBL18044465 | 0.84 | CA1 (0.50) | TDP1CA1CA2CA12CA9 | |
| SCHEMBL18044458 | 0.83 | CA1 (0.47) | TDP1CA1CA2CA12CA9 | |
| SCHEMBL8480830 | 0.77 | EGFR (0.45) | TDP1CA1CA2CA12CA9 | |
| SCHEMBL20709025 | 0.76 | MAPT (0.44) | TDP1CA1CA2CA12CA9 | |
| SCHEMBL3518044 | 0.75 | CA12 (0.48) | TDP1CA1CA2CA12CA9 | |
| SCHEMBL2337244 | 0.74 | CA1 (0.70) | TDP1CA1CA2CA12CA9 | |
| SCHEMBL3205636 | 0.74 | CA12 (0.44) | TDP1CA1CA2CA12CA9 | |
| SCHEMBL1495863 | 0.74 | HDAC1 (0.62) | TDP1CA1CA2CA12CA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015062555-A1 | COMPOUND HAVING HIGHER INHIBITION OF PROTEIN KINASE G ACTIVITY AND PREPARATION METHOD THEREFOR | 天津键凯科技有限公司 | 2015-05-07 | — | — | WO | disclosed |