Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| SCHEMBL6055166 | 0.91 | ALDH1A1 (0.45) | ALDH1A1TSHRTDP1CA2GABRA1 | |
| SCHEMBL13907322 | 0.86 | ALDH1A1 (0.48) | ALDH1A1TSHRTDP1CA2GABRA1 | |
| SCHEMBL8274423 | 0.86 | ALDH1A1 (0.48) | ALDH1A1TSHRTDP1CA2GABRA1 | |
| SCHEMBL6055359 | 0.86 | ALDH1A1 (0.48) | ALDH1A1TSHRTDP1CA2GABRA1 | |
| SCHEMBL18929401 | 0.84 | ALDH1A1 (0.46) | ALDH1A1TSHRTDP1CA2GABRA1 | |
| Hydrogen Peroxide SCHEMBL49977 | 0.81 | GABRA1 (0.48) | ALDH1A1TSHRTDP1CA2GABRA1 | |
| SCHEMBL6055159 | 0.81 | LMNA (0.47) | ALDH1A1TSHRTDP1CA2GABRA1 | |
| SCHEMBL7148845 | 0.81 | TSHR (0.43) | ALDH1A1TSHRTDP1CA2GABRA1 | |
| SCHEMBL8938349 | 0.81 | CYP2C9 (0.49) | ALDH1A1TSHRTDP1CA2CYP3A4 | |
| SCHEMBL4667743 | 0.80 | GABRA1 (0.46) | ALDH1A1TSHRTDP1CA2GABRA1 |
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-6242514-B1 | CYCLIC PHOSPHATE OR PHOSPHONATE; HEAT AND OXIDATION STABILIZER ESPECIALLY FOR OLEFIN POLYMERS AND ENGINEERING THERMOPLASTICS | SUMITOMO CHEMICAL COMPANY, LTD. (JP) | 2001-06-05 | — | — | US | disclosed |