Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 8/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL16771841 | 0.84 | ACHE (0.47) | ALDH1A1MAPTKMT2ACYP2C19HIF1A | |
| SCHEMBL16081706 | 0.81 | PARP1 (0.44) | KIF11PARP1CA1CA2CA9 | |
| SCHEMBL2498564 | 0.80 | CYP3A4 (0.41) | KIF11HSD17B1HSD17B2ALDH1A1CYP3A4 | |
| SCHEMBL2813766 | 0.80 | MAPT (0.55) | KIF11ALDH1A1CYP3A4MAPTKMT2A | |
| SCHEMBL3978037 | 0.78 | TAAR1 (0.57) | KIF11HSD17B1HSD17B2ALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL5789392 | 0.78 | MAPT (0.53) | KIF11ALDH1A1CYP3A4MAPTKMT2A | |
| SCHEMBL17700298 | 0.78 | POLB (0.44) | HSD17B1HSD17B2ALDH1A1CYP3A4CA12 | |
| Hydrochloric Acid SCHEMBL5800348 | 0.77 | TAAR1 (0.55) | KIF11HSD17B1HSD17B2ALDH1A1CYP3A4 | |
| SCHEMBL27640014 | 0.77 | MAPT (0.62) | KIF11PARP1HSD17B1HSD17B2ALDH1A1 | |
| SCHEMBL31215161 | 0.76 | LMNA (0.44) | KIF11HSD17B1HSD17B2ALDH1A1CYP3A4 |
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-104244944-A | Compounds for treating spinal muscular atrophy | PTC THERAPEUTICS INC | 2014-12-24 | — | — | CN | disclosed |