Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | PTPRC | P08575 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 5/20 | 0.35 |
| ▸ | HTR1A | P08908 | 4/20 | 0.35 |
| ▸ | HTR2B | P41595 | 4/20 | 0.35 |
| ▸ | HTR2C | P28335 | 3/20 | 0.35 |
| ▸ | HTR5A | P47898 | 3/20 | 0.35 |
| ▸ | HTR1D | P28221 | 2/20 | 0.35 |
| ▸ | HTR1B | P28222 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6317239 | 0.77 | CYP3A4 (0.45) | CYP3A4ALDH1A1HPGDTDP1HDAC4 | |
| SCHEMBL440576 | 0.76 | GABRA1 (0.46) | CYP3A4ALDH1A1HPGDTDP1APP | |
| SCHEMBL2169591 | 0.75 | CYP3A4 (0.52) | CYP3A4ALDH1A1HPGDTDP1HDAC4 | |
| SCHEMBL5321194 | 0.74 | ALDH1A1 (0.41) | CYP3A4ALDH1A1HPGDTDP1HDAC4 | |
| SCHEMBL11129483 | 0.73 | CYP3A4 (0.54) | CYP3A4ALDH1A1HPGDTDP1SMN1; SMN2 | |
| SCHEMBL11663956 | 0.73 | CYP3A4 (0.68) | CYP3A4ALDH1A1HPGDTDP1PTPRC | |
| SCHEMBL28578200 | 0.73 | ALDH1A1 (0.42) | CYP3A4ALDH1A1HPGDTDP1SMN1; SMN2 | |
| SCHEMBL77114 | 0.72 | ALDH1A1 (0.61) | CYP3A4ALDH1A1HPGDTDP1TSHR | |
| SCHEMBL29471398 | 0.72 | ALDH1A1 (0.61) | CYP3A4ALDH1A1HPGDTDP1TSHR | |
| SCHEMBL1332133 | 0.72 | CYP3A4 (0.57) | CYP3A4ALDH1A1HPGDTDP1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012121997-A1 | POLYTHIOURETHAN BASED COMPOSITE ARTICLES | PPG INDUSTRIES OHIO, INC. (US) | 2012-09-13 | — | — | WO | disclosed |
| EP-0543409-A2 | Insulated wire | SUMITOMO ELECTRIC INDUSTRIES, LTD (JP) | 1993-05-26 | — | — | EP | disclosed |