Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP24A1 | Q07973 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | PSMD10 | O75832 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5658838 | 0.84 | TSHR (0.41) | ALDH1A1KDM4ESMN1; SMN2CA12CA1 | |
| SCHEMBL28634383 | 0.83 | CA12 (0.49) | KDM4ECA12CA1CA9CA2 | |
| SCHEMBL31281892 | 0.80 | TSHR (0.40) | ALDH1A1KDM4EHTTCA12CA1 | |
| SCHEMBL2796220 | 0.79 | ALDH1A1 (0.50) | ALDH1A1KDM4EHTTSMN1; SMN2CA12 | |
| SCHEMBL16934934 | 0.79 | CA12 (0.46) | ALDH1A1KDM4EHTTSMN1; SMN2CA12 | |
| SCHEMBL27794804 | 0.77 | CA12 (0.46) | ALDH1A1KDM4ECA12CA1CA9 | |
| SCHEMBL6647468 | 0.75 | CA1 (0.41) | ALDH1A1KDM4EHTTCA12CA1 | |
| SCHEMBL4592604 | 0.75 | MMP2 (0.39) | ALDH1A1KDM4ECA12CA1CA9 | |
| SCHEMBL1464358 | 0.75 | ALDH1A1 (0.57) | ALDH1A1KDM4EKMT2APOLBTSHR | |
| SCHEMBL241884 | 0.75 | CA1 (0.52) | ALDH1A1HTTSMN1; SMN2CA12CA1 |
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-0999205-A1 | AMINOCYCLOALKANE COMPOUNDS | Mitsubishi-Tokyo Pharmaceuticals, Inc. (JP) | 2000-05-10 | — | — | EP | disclosed |