Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.37 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28294117 | 0.76 | XDH (0.38) | CYP3A4XDHGABRA1GABRB2MAPT | |
| SCHEMBL472453 | 0.72 | GABRA1 (0.41) | XDHGABRA1GABRB2MAPTKMT2A | |
| SCHEMBL7582780 | 0.72 | CYP3A4 (0.50) | CYP3A4TSHRTDP1GABRA1GABRB2 | |
| SCHEMBL22139408 | 0.72 | XDH (0.45) | CYP3A4XDHGABRA1GABRB2MAPT | |
| SCHEMBL9742119 | 0.72 | XDH (0.45) | CYP3A4XDHGABRA1GABRB2MAPT | |
| SCHEMBL11575822 | 0.72 | XDH (0.31) | XDHGABRA1GABRB2MAPTKMT2A | |
| SCHEMBL17969003 | 0.70 | XDH (0.59) | CYP3A4TSHRXDHGABRA1GABRB2 | |
| Formaldehyde SCHEMBL27719025 | 0.69 | SRD5A1 (0.41) | XDHGABRA1GABRB2MAPTKMT2A | |
| SCHEMBL28416632 | 0.68 | XDH (0.52) | CYP3A4XDHGABRA1GABRB2MAPT | |
| SCHEMBL29115719 | 0.68 | PTPN1 (0.47) | CYP3A4XDHGABRA1GABRB2MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4924021-A | Cyclic phenol organosilanes and method for their preparation | HUELS AKTIENGESELLSCHAFT (DE) | 1990-05-08 | — | — | US | disclosed |
| EP-0132651-A2 | Use of cyclic phenol organosilane ester | HÜLS AKTIENGESELLSCHAFT (DE) | 1985-02-13 | — | — | EP | disclosed |