Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA4 | P22748 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL258944 | 0.97 | — | — | |
| SCHEMBL14654388 | 0.97 | — | — | |
| SCHEMBL29236891 | 0.89 | THRB (0.47) | THRBMEN1KMT2ACA1CA2 | |
| SCHEMBL9679797 | 0.82 | — | — | |
| SCHEMBL8024156 | 0.82 | — | — | |
| SCHEMBL770374 | 0.82 | — | — | |
| SCHEMBL10985092 | 0.82 | — | — | |
| Hydrochloric Acid SCHEMBL1032687 | 0.79 | CA1 (0.36) | THRBMEN1KMT2ACA1CA2 | |
| SCHEMBL18611199 | 0.79 | — | — | |
| SCHEMBL20841809 | 0.79 | — | — |
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-1828097-B1 | METHOD FOR PRODUCING 1,2-DIAMINO-3-METHYLCYCLOHEXANE AND/OR 1,2-DIAMINO-4-METHYLCYCLOHEXANE | BASF SE (DE) | 2008-05-07 | — | — | EP | disclosed |