Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.40 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | GFER | P55789 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8145953 | 0.80 | ALDH1A1 (0.44) | KMT2AMEN1CYP1A2CYP4F2CYP4A11 | |
| SCHEMBL1295475 | 0.80 | ALOX5 (0.47) | KMT2AMEN1CYP1A2CYP4F2CYP4A11 | |
| Hydrochloric Acid SCHEMBL27680687 | 0.79 | ALOX5 (0.46) | KMT2AMEN1CYP1A2CYP4F2CYP4A11 | |
| SCHEMBL13225707 | 0.79 | NPC1 (0.42) | KMT2AMEN1CYP1A2CYP4F2CYP4A11 | |
| SCHEMBL20561794 | 0.79 | KMT2A (0.41) | KMT2AMEN1CYP1A2CYP4F2CYP4A11 | |
| SCHEMBL27347187 | 0.79 | ALDH1A1 (0.42) | KMT2AMEN1CYP1A2CYP4F2CYP4A11 | |
| SCHEMBL9925412 | 0.79 | ALDH1A1 (0.46) | KMT2AMEN1CYP1A2CYP4F2CYP4A11 | |
| SCHEMBL8060939 | 0.79 | KMT2A (0.41) | KMT2AMEN1CYP1A2CYP4F2CYP4A11 | |
| SCHEMBL1295929 | 0.78 | KMT2A (0.40) | KMT2AMEN1CYP1A2CYP4F2CYP4A11 | |
| SCHEMBL2719139 | 0.77 | KMT2A (0.46) | KMT2AMEN1CYP1A2CYP4F2CYP4A11 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012075678-A1 | SUBSTITUTED THIAZOLYL PYRAZOLO PYRIDINE COMPOUND AND MEDICINAL USE THEREOF | 中国人民解放军军事医学科学院毒物药物研究所 (CN) | 2012-06-14 | — | — | WO | disclosed |