Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.36 |
| ▸ | SELL | P14151 | 1/20 | 0.35 |
| ▸ | SELP | P16109 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.35 |
| ▸ | GABRD | O14764 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28346746 | 0.96 | CYP1A2 (0.39) | CYP1A2HTTALDH1A1ALOX15ACMSD | |
| SCHEMBL29664884 | 0.93 | CYP1A2 (0.48) | CYP1A2ALDH1A1ALOX15ACMSDPTPN1 | |
| SCHEMBL125463 | 0.93 | CYP1A2 (0.48) | CYP1A2ALDH1A1ALOX15ACMSDPTPN1 | |
| SCHEMBL1193168 | 0.91 | CYP1A2 (0.42) | CYP1A2HTTALDH1A1ALOX15SELL | |
| Ethylene Glycol SCHEMBL25436654 | 0.91 | CYP1A2 (0.46) | CYP1A2ALDH1A1ALOX15ACMSDPTPN1 | |
| SCHEMBL7742108 | 0.89 | PPARA (0.41) | CYP1A2HTTALDH1A1ALOX15PPARA | |
| SCHEMBL1060065 | 0.89 | CYP1A2 (0.44) | CYP1A2HTTALDH1A1ALOX15SELL | |
| SCHEMBL11276749 | 0.85 | TDP1 (0.42) | ALDH1A1KDM4ETDP1TSHR | |
| SCHEMBL27364912 | 0.83 | GABRP (0.41) | CYP1A2ALDH1A1ALOX15ACMSDPTPN1 | |
| SCHEMBL7705466 | 0.83 | CYP1A2 (0.39) | CYP1A2ALDH1A1ALOX15ACMSDPTPN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4358508-A | AUTOMOBILE OVERCOATINGS | MITSUBISHI RAYON CO., LTD. (JP) | 1982-11-09 | — | — | US | disclosed |