Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 8/20 | 0.39 |
| ▸ | CA1 | P00915 | 8/20 | 0.39 |
| ▸ | CA2 | P00918 | 8/20 | 0.39 |
| ▸ | CA4 | P22748 | 5/20 | 0.39 |
| ▸ | CA5A | P35218 | 5/20 | 0.39 |
| ▸ | CA7 | P43166 | 5/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 5/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6197791 | 0.89 | TSHR (0.48) | TSHRPTPN1ALDH1A1LMNAKDM4E | |
| SCHEMBL14190561 | 0.83 | TSHR (0.51) | TSHRPTPN1ALDH1A1LMNAKDM4E | |
| SCHEMBL5071985 | 0.82 | TSHR (0.49) | TSHRPTPN1ALDH1A1LMNAKDM4E | |
| SCHEMBL8205660 | 0.69 | ALDH1A1 (0.65) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL4425824 | 0.69 | ALDH1A1 (0.65) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL23982402 | 0.69 | ALDH1A1 (0.65) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL10033986 | 0.69 | ALDH1A1 (0.65) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 | |
| SCHEMBL6422031 | 0.69 | HIF1A (0.52) | TSHRALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL6887838 | 0.69 | TSHR (0.49) | TSHRPTPN1ALDH1A1LMNAKDM4E | |
| SCHEMBL19889158 | 0.69 | ALDH1A1 (0.65) | ALDH1A1LMNAMAPTSMN1; SMN2TP53 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7368437-B1 | Bicyclic heterocycles, processes for their preparation and their use as herbicides and pharmaceutical agents | BAYER CROPSCIENCE AG (DE) | 2008-05-06 | — | — | US | disclosed |
| US-7368437-B1 | Bicyclic heterocycles, processes for their preparation and their use as herbicides and pharmaceutical agents | BAYER CROPSCIENCE AG (DE) | 2008-05-06 | — | — | US | disclosed |