Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 5/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.35 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL49939 | 0.75 | ALDH1A1 (0.40) | ALDH1A1TSHRTDP1CA1CA2 | |
| Ammonia Solution, Strong SCHEMBL6301069 | 0.72 | ALDH1A1 (0.38) | ALDH1A1TSHRTDP1CA1CA2 | |
| Hydrochloric Acid SCHEMBL27449759 | 0.72 | ALDH1A1 (0.38) | ALDH1A1TSHRTDP1CA1CA2 | |
| SCHEMBL31585928 | 0.72 | ALDH1A1 (0.38) | ALDH1A1TSHRTDP1CA1CA2 | |
| SCHEMBL28105654 | 0.72 | ALDH1A1 (0.38) | ALDH1A1TSHRTDP1CA1CA2 | |
| SCHEMBL2166400 | 0.69 | ALDH1A1 (0.35) | ALDH1A1TSHRTDP1CA1CA2 | |
| SCHEMBL1538843 | 0.69 | ALDH1A1 (0.39) | ALDH1A1TSHRTDP1CA1CA2 | |
| SCHEMBL1624424 | 0.69 | — | — | |
| SCHEMBL150127 | 0.69 | TSHR (0.39) | ALDH1A1TSHRTDP1CA1CA2 | |
| SCHEMBL1539021 | 0.69 | — | — |
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-1999030821-A1 | CATALYST COMPOSITIONS FOR OLEFIN POLYMERIZATION BASED ON METALLOCENE COMPLEXES AND NOVEL COCATALYSTS PRODUCED FROM TRIALKYLALUMINUM COMPOUNDS, STERICALLY HINDERED PHENOLS, AND WATER | MOBIL OIL CORPORATION (US) | 1999-06-24 | — | — | WO | disclosed |