Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | APP | P05067 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | NQO1 | P15559 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 1/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | NSD2 | O96028 | 1/20 | 0.39 |
| ▸ | CASP6 | P55212 | 1/20 | 0.39 |
| ▸ | G6PD | P11413 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5748942 | 0.90 | IDO1 (0.43) | ALDH1A1TDP1ADRA2BPTGS1MCHR1 | |
| SCHEMBL5746447 | 0.83 | IDO1 (0.47) | ALDH1A1TDP1ADRA2BPTGS1MCHR1 | |
| SCHEMBL4018577 | 0.81 | ALDH1A1 (0.52) | ALDH1A1TDP1CYP3A4TSHRHSD17B10 | |
| SCHEMBL5748760 | 0.79 | IDO1 (0.50) | ALDH1A1TDP1ADRA2BPTGS1MCHR1 | |
| SCHEMBL16241709 | 0.78 | CYP1A2 (0.52) | ALDH1A1TDP1CYP3A4TSHRHSD17B10 | |
| SCHEMBL2351815 | 0.77 | HPGD (0.54) | ALDH1A1TDP1MCHR1CYP3A4TSHR | |
| SCHEMBL5748372 | 0.77 | CYP1A2 (0.43) | ALDH1A1TDP1MCHR1CYP3A4TSHR | |
| SCHEMBL5746036 | 0.77 | ALDH1A1 (0.59) | ALDH1A1TDP1CYP3A4TSHRHSD17B10 | |
| SCHEMBL5749206 | 0.76 | CYP1A2 (0.46) | ALDH1A1TDP1ADRA2BPTGS1MCHR1 | |
| SCHEMBL23272061 | 0.76 | CYP1A2 (0.48) | ALDH1A1TDP1CYP3A4TSHRHSD17B10 |
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-20060293503-A1 | Polyaminopyridines and method for producing same | SUMITOMO SEIKA CHEMICALS CO., LTD (JP) | 2006-12-28 | — | — | US | disclosed |
| EP-1669390-A1 | POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME | SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) | 2006-06-14 | — | — | EP | disclosed |