Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 5/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6541282 | 0.84 | HPRT1 (0.64) | HPRT1ALDH1A1HSD17B10TSHRCYP2A6 | |
| SCHEMBL9572742 | 0.84 | HPRT1 (0.64) | HPRT1ALDH1A1HSD17B10TSHRCYP2A6 | |
| SCHEMBL16760997 | 0.84 | ALDH1A1 (0.57) | HPRT1ALDH1A1HSD17B10TSHRCYP2A6 | |
| SCHEMBL16194313 | 0.83 | HPRT1 (0.56) | HPRT1ALDH1A1HSD17B10TSHRCYP2A6 | |
| SCHEMBL21645599 | 0.83 | HPRT1 (0.61) | HPRT1ALDH1A1HSD17B10TSHRCYP2A6 | |
| SCHEMBL24055799 | 0.82 | ALDH1A1 (0.47) | HPRT1ALDH1A1HSD17B10TSHRCYP2A6 | |
| SCHEMBL383693 | 0.81 | HPRT1 (0.74) | HPRT1ALDH1A1HSD17B10TSHRCYP2A6 | |
| SCHEMBL18844847 | 0.80 | MAPK14 (0.56) | HPRT1ALDH1A1HSD17B10TSHRCYP2A6 | |
| SCHEMBL20462472 | 0.79 | ALDH1A1 (0.57) | HPRT1ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL4849433 | 0.79 | ALDH1A1 (0.52) | HPRT1ALDH1A1HSD17B10TSHRCYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0780340-B1 | Intercalates and exfoliates formed with functional monomeric organic compounds; composite materials containing same and methods of modifying rheology therewith | AMCOL INTERNATIONAL CORP (US) | 2002-03-20 | — | — | EP | disclosed |