Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH4 | Q9H3N8 | 11/20 | 0.47 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | TNF | P01375 | 1/20 | 0.38 |
| ▸ | IL1B | P01584 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28151083 | 0.87 | CA1 (0.49) | HRH4TLR8CA12CA1CA2 | |
| SCHEMBL28151132 | 0.83 | CA1 (0.56) | HRH4CA12CA1CA2CA9 | |
| SCHEMBL28151081 | 0.82 | HRH4 (0.44) | HRH4TLR8CA12CA1CA2 | |
| SCHEMBL28845276 | 0.82 | HRH4 (0.43) | HRH4TLR8CA12CA1CA2 | |
| SCHEMBL15757268 | 0.81 | NUDT1 (0.54) | HRH4TLR8CA12CA1CA2 | |
| SCHEMBL28152251 | 0.81 | CA1 (0.55) | CA12CA1CA2CA9CA7 | |
| SCHEMBL28151149 | 0.81 | HRH4 (0.64) | HRH4TLR8 | |
| SCHEMBL28845262 | 0.80 | HRH4 (0.47) | HRH4TLR8PTGDR | |
| SCHEMBL28265645 | 0.79 | TLR8 (0.44) | HRH4TLR8CA12CA1CA2 | |
| SCHEMBL28152093 | 0.79 | HRH4 (0.48) | HRH4TLR8 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105143206-B | Pyrimidine -2,4- diamine derivative for treating cancer | 托马斯·黑勒戴药物研究基金会 | 2019-01-15 | — | — | CN | claimed |
| CN-105143206-B | Pyrimidine -2,4- diamine derivative for treating cancer | 托马斯·黑勒戴药物研究基金会 | 2019-01-15 | — | — | CN | disclosed |
| CN-106794181-A | MTH1 inhibitors for the treatment of inflammatory and autoimmune conditions | 托马斯·黑勒戴药物研究基金会 | 2017-05-31 | — | — | CN | disclosed |