Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 7/20 | 0.59 |
| ▸ | CA2 | P00918 | 7/20 | 0.59 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | CASP7 | P55210 | 1/20 | 0.48 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.48 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8733 | 0.84 | CA1 (0.59) | CA1CA2ADORA3KDM4ECYP3A4 | |
| SCHEMBL8665 | 0.84 | CA1 (0.59) | CA1CA2ADORA3KDM4ECYP3A4 | |
| SCHEMBL8612 | 0.81 | CA1 (0.56) | CA1CA2ADORA3KDM4ECYP3A4 | |
| SCHEMBL9311 | 0.81 | CA1 (0.56) | CA1CA2ADORA3KDM4ECYP3A4 | |
| SCHEMBL15527966 | 0.81 | CA1 (0.56) | CA1CA2ADORA3KDM4ECYP3A4 | |
| SCHEMBL29268870 | 0.80 | CA1 (0.55) | CA1CA2ADORA3KDM4ECYP3A4 | |
| SCHEMBL15327813 | 0.80 | CA1 (0.55) | CA1CA2ADORA3KDM4ECYP3A4 | |
| SCHEMBL9595 | 0.79 | CA1 (0.54) | CA1CA2ADORA3KDM4ECYP3A4 | |
| SCHEMBL15528187 | 0.79 | CA1 (0.54) | CA1CA2ADORA3KDM4ECYP3A4 | |
| SCHEMBL28837640 | 0.78 | CA1 (0.52) | CA1CA2ADORA3KDM4ECYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1129445-A | Isoflavone derivatives | CHINOIN GYOGYSZER ES VEGYESZET (HU) | 1996-08-21 | — | — | CN | disclosed |