Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 8/20 | 0.50 |
| ▸ | CA2 | P00918 | 5/20 | 0.50 |
| ▸ | CA12 | O43570 | 3/20 | 0.50 |
| ▸ | CA9 | Q16790 | 3/20 | 0.50 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | THRB | P10828 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | CA3 | P07451 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 3/20 | 0.41 |
| ▸ | FGB | P02675 | 1/20 | 0.41 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28861312 | 0.86 | CA12 (0.54) | CA1CA2CA12CA9PIK3CG | |
| SCHEMBL17680740 | 0.84 | MEN1 (0.43) | CA2ALDH1A1THRBMEN1MAPT | |
| SCHEMBL517089 | 0.74 | CYP2A6 (0.50) | CA1CA2CA12CA9PIK3CG | |
| SCHEMBL18000199 | 0.72 | BRPF1 (0.52) | LMNAALDH1A1THRBMEN1MAPT | |
| SCHEMBL5986735 | 0.71 | MAPT (0.52) | ALDH1A1THRBMEN1MAPTKMT2A | |
| SCHEMBL31721767 | 0.71 | ALDH1A1 (0.46) | CA1CA2CA12CA9PIK3CG | |
| SCHEMBL8761290 | 0.70 | PRKCI (0.55) | CA1CA2CA12CA9PIK3CG | |
| SCHEMBL3728185 | 0.70 | CA1 (0.71) | CA1CA2CA12CA9PIK3CG | |
| SCHEMBL9839080 | 0.70 | LMNA (0.82) | CA1CA2CA12CA9LMNA | |
| SCHEMBL7022395 | 0.69 | MEN1 (0.52) | ALDH1A1THRBMEN1MAPTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-110036004-A | Inhibitors of cyclin dependent kinase 7(CDK7) | 希洛斯医药品股份有限公司 | 2019-07-19 | — | — | CN | disclosed |