Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Pyrimidine SCHEMBL27480983 | 1.00 | — | — | |
| Pyrimidine SCHEMBL10847950 | 0.96 | — | — | |
| Pyrimidine SCHEMBL27755630 | 0.87 | — | — | |
| Pyrimidine SCHEMBL6837713 | 0.87 | — | — | |
| Pyrimidine SCHEMBL10646 | 0.87 | TSHR (0.50) | TSHRNAPRTTDP1CYP2A6HSP90AA1 | |
| Pyrimidine SCHEMBL1846 | 0.87 | — | — | |
| Pyrimidine SCHEMBL19437633 | 0.87 | TSHR (0.50) | TSHRNAPRTTDP1CYP2A6HSP90AA1 | |
| Pyrimidine SCHEMBL28362645 | 0.83 | — | — | |
| Pyrimidine SCHEMBL4422279 | 0.83 | — | — | |
| Pyrimidine SCHEMBL27941857 | 0.83 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101589024-B | Minor groove binders | UNIV STRATHCLYDE | 2014-01-01 | — | — | CN | disclosed |
| CN-101918368-B | Method for improving the hydrolysis stability of ionic liquids | BASF SE | 2013-04-24 | — | — | CN | disclosed |
| CN-101918368-A | Method for improving the hydrolysis stability of ionic liquids | BASF SE | 2010-12-15 | — | — | CN | disclosed |
| CN-101589024-A | Novel minor groove binders | UNIV STRATHCLYDE (GB) | 2009-11-25 | — | — | CN | disclosed |