Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.53 |
| ▸ | ACHE | P22303 | 1/20 | 0.53 |
| ▸ | TACR2 | P21452 | 1/20 | 0.53 |
| ▸ | GFER | P55789 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL24569593 | 0.87 | OPRD1 (0.50) | HRH3SIGMAR1ACHE | |
| SCHEMBL28037481 | 0.87 | ALDH1A1 (0.58) | HRH3ALDH1A1KMT2AACHE | |
| SCHEMBL14174804 | 0.85 | NPSR1 (0.52) | HRH3ALDH1A1KMT2ASIGMAR1 | |
| SCHEMBL16565552 | 0.84 | KDM4E (0.51) | HRH3ALDH1A1ACHE | |
| SCHEMBL7251010 | 0.81 | ALDH1A1 (0.58) | HRH3ALDH1A1KMT2ASIGMAR1GFER | |
| SCHEMBL15742584 | 0.81 | SIGMAR1 (0.46) | HRH3SIGMAR1 | |
| SCHEMBL16565555 | 0.81 | ALDH1A1 (0.50) | HRH3ALDH1A1KMT2AACHE | |
| SCHEMBL9995252 | 0.81 | ALDH1A1 (0.50) | HRH3ALDH1A1KMT2ASIGMAR1GFER | |
| SCHEMBL10149206 | 0.80 | DRD4 (0.53) | HRH3ALDH1A1KMT2ASIGMAR1 | |
| SCHEMBL11210779 | 0.79 | KMT2A (0.56) | ALDH1A1KMT2AACHE |
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-108473478-A | TBK/IKK inhibitor compounds and uses thereof | 默克专利有限公司 | 2018-08-31 | — | — | CN | disclosed |
| EP-1809614-A2 | BENZOTRIAZINE INHIBITORS OF KINASES | Targegen, Inc. (US) | 2007-07-25 | — | — | EP | disclosed |
| WO-2005096784-A2 | BENZOTRIAZINE INHIBITORS OF KINASES | TARGEGEN, INC. (US) | 2005-10-20 | — | — | WO | disclosed |