Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 3/20 | 0.54 |
| ▸ | XDH | P47989 | 2/20 | 0.54 |
| ▸ | CA12 | O43570 | 4/20 | 0.42 |
| ▸ | CA2 | P00918 | 4/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 6/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10288998 | 0.82 | MPO (0.56) | MPOXDHCA12CA2CA1 | |
| SCHEMBL15215602 | 0.75 | MPO (0.58) | MPOXDHCA12CA2CA1 | |
| SCHEMBL2731359 | 0.73 | KMT2A (0.70) | MPOXDHMEN1KMT2ARXFP1 | |
| SCHEMBL4104209 | 0.72 | KDM4E (0.47) | CA12PKMSMN1; SMN2ALDH1A1CA9 | |
| SCHEMBL2730975 | 0.71 | MPO (1.00) | MPOXDHCA12CA2CA1 | |
| SCHEMBL15215607 | 0.69 | MPO (0.51) | MPOXDHCA12CA2CA1 | |
| SCHEMBL2730278 | 0.69 | KDM4E (0.65) | MPOXDHMEN1KMT2APKM | |
| SCHEMBL15215601 | 0.68 | MPO (0.66) | MPOXDHCA12CA2CA1 | |
| SCHEMBL2731084 | 0.68 | ALDH1A1 (0.68) | MPOXDHMEN1KMT2AMAPT | |
| SCHEMBL2731110 | 0.67 | MPO (0.82) | MPOXDHPKMALDH1A1POLB |
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-2012058211-A2 | QUINAZOLINE DERIVATIVES, COMPOSITIONS, AND USES RELATED THERETO | EMORY UNIVERSITY (US) | 2012-05-03 | — | — | WO | disclosed |