Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.44 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL39342 | 0.89 | CYP19A1 (0.53) | CYP19A1ALDH1A1KMT2AMEN1POLB | |
| SCHEMBL44780 | 0.84 | ALDH1A1 (0.44) | CYP19A1ALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL44302 | 0.84 | SMN1; SMN2 (0.50) | CYP19A1ALDH1A1KMT2AMEN1POLB | |
| SCHEMBL44636 | 0.82 | TP53 (0.43) | CYP19A1ALDH1A1THRBKMT2AMEN1 | |
| SCHEMBL44557 | 0.82 | KMT2A (0.40) | CYP19A1ALDH1A1THRBKMT2AMEN1 | |
| SCHEMBL44918 | 0.82 | CYP19A1 (0.44) | CYP19A1ALDH1A1POLBMAPTLMNA | |
| SCHEMBL45229 | 0.80 | TP53 (0.41) | CYP19A1ALDH1A1THRBKMT2AMEN1 | |
| SCHEMBL44139 | 0.80 | ALDH1A1 (0.43) | CYP19A1ALDH1A1THRBMAPTLMNA | |
| SCHEMBL44674 | 0.76 | MAPT (0.52) | POLBMAPTTP53 | |
| SCHEMBL44862 | 0.76 | GAA (0.47) | CYP19A1ALDH1A1THRBPOLBGAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011137587-A1 | CYTOKINE INHIBITORS | HUTCHISON MEDIPHARMA LIMITED (CN) | 2011-11-10 | — | — | WO | claimed |
| WO-2011137587-A1 | CYTOKINE INHIBITORS | HUTCHISON MEDIPHARMA LIMITED (CN) | 2011-11-10 | — | — | WO | disclosed |
| WO-2011137587-A1 | CYTOKINE INHIBITORS | HUTCHISON MEDIPHARMA LIMITED (CN) | 2011-11-10 | — | — | WO | disclosed |