Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 7/20 | 0.39 |
| ▸ | ACHE | P22303 | 8/20 | 0.37 |
| ▸ | MMP2 | P08253 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GSR | P00390 | 1/20 | 0.34 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6036958 | 0.83 | MEN1 (0.40) | TSHRHTTMEN1ABCB11ALDH1A1 | |
| SCHEMBL11032565 | 0.82 | ALDH1A1 (0.34) | TSHRHTTMEN1ABCB11ALDH1A1 | |
| SCHEMBL10714633 | 0.79 | ALDH1A1 (0.43) | TSHRHTTMEN1ABCB11ALDH1A1 | |
| SCHEMBL2465797 | 0.71 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL9474824 | 0.71 | EPHX1 (0.47) | EPHX1ACHEMMP2TSHRHTT | |
| SCHEMBL9351242 | 0.69 | ALDH1A2 (0.50) | EPHX1ACHEMMP2ALDH1A1 | |
| SCHEMBL8173536 | 0.68 | EPHX1 (0.52) | EPHX1ACHEMMP2TSHRHTT | |
| SCHEMBL3091042 | 0.68 | EPHX1 (0.52) | EPHX1ACHEMMP2TSHRHTT | |
| SCHEMBL19741363 | 0.67 | EPHX1 (0.42) | EPHX1ACHEMMP2TSHRHTT | |
| SCHEMBL11875688 | 0.66 | EPHX1 (0.50) | EPHX1ACHEMMP2TSHRHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0117959-A2 | Nitrosourea derivatives, process for their preparation and pharmaceutical compositions containing them | ADIR (FR) | 1984-09-12 | — | — | EP | disclosed |