Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 11/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | SHBG | P04278 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7415927 | 0.81 | SMN1; SMN2 (0.41) | SMN1; SMN2EPHX1KDM4EALDH1A1SHBG | |
| SCHEMBL12166574 | 0.79 | SMN1; SMN2 (0.41) | SMN1; SMN2EPHX1KDM4EALDH1A1SHBG | |
| SCHEMBL439640 | 0.79 | SMN1; SMN2 (0.49) | SMN1; SMN2EPHX1KDM4EALDH1A1SHBG | |
| SCHEMBL2125596 | 0.79 | SMN1; SMN2 (0.40) | SMN1; SMN2EPHX1KDM4EALDH1A1SHBG | |
| SCHEMBL2996218 | 0.78 | NAAA (0.47) | EPHX1 | |
| SCHEMBL2991949 | 0.78 | NAAA (0.47) | EPHX1 | |
| Ammonia Solution, Strong SCHEMBL27751845 | 0.78 | SMN1; SMN2 (0.47) | SMN1; SMN2EPHX1KDM4EALDH1A1SHBG | |
| SCHEMBL3020502 | 0.78 | SMN1; SMN2 (0.41) | SMN1; SMN2EPHX1KDM4EALDH1A1SHBG | |
| SCHEMBL4281689 | 0.78 | EPHX1 (0.50) | SMN1; SMN2EPHX1KDM4EALDH1A1SHBG | |
| SCHEMBL4978863 | 0.77 | SMN1; SMN2 (0.46) | SMN1; SMN2EPHX1ALDH1A1SHBGCYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-4240983-A | HALOGENATION | BAYER AKTIENGESELLSCHAFT (DE) | 1980-12-23 | — | — | US | disclosed |