Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.61 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.41 |
| ▸ | GRM8 | O00222 | 1/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8909509 | 1.00 | CYP1A2 (0.61) | CYP1A2TSHRALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL3697952 | 0.87 | CYP1A2 (0.59) | CYP1A2TSHRALDH1A1CYP3A4CYP2D6 | |
| Cadaverine Tartrate SCHEMBL28015425 | 0.83 | CYP1A2 (0.56) | CYP1A2TSHRALDH1A1MAPTTDP1 | |
| SCHEMBL21853757 | 0.83 | CYP1A2 (0.58) | CYP1A2TSHRALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL21853755 | 0.83 | CYP1A2 (0.58) | CYP1A2TSHRALDH1A1CYP3A4CYP2D6 | |
| SCHEMBL1694959 | 0.82 | CYP1A2 (0.65) | CYP1A2TSHRALDH1A1MAPTTDP1 | |
| SCHEMBL1694961 | 0.82 | CYP1A2 (0.65) | CYP1A2TSHRALDH1A1MAPTTDP1 | |
| SCHEMBL8805936 | 0.82 | CYP1A2 (0.65) | CYP1A2TSHRALDH1A1MAPTTDP1 | |
| SCHEMBL1694960 | 0.82 | CYP1A2 (0.65) | CYP1A2TSHRALDH1A1MAPTTDP1 | |
| SCHEMBL20537468 | 0.81 | ALDH1A1 (0.70) | CYP1A2TSHRALDH1A1CYP3A4CYP2D6 |
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-5670664-A | Photosensitive organic compounds that release carbon monoxide upon illumination | UNIVERSITY OF MARYLAND BIOTECHNOLOGY INSTITUTE (US) | 1997-09-23 | — | — | US | disclosed |