Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 4/20 | 0.51 |
| ▸ | PNMT | P11086 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.45 |
| ▸ | CA2 | P00918 | 3/20 | 0.45 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | CA6 | P23280 | 1/20 | 0.45 |
| ▸ | CA5A | P35218 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1795003 | 0.82 | CA2 (0.64) | HTR6PNMTCA1CA2ENPP2 | |
| SCHEMBL1598016 | 0.82 | ALDH1A1 (0.48) | HTR6ALDH1A1HSD17B10TDP1CA1 | |
| SCHEMBL1127911 | 0.80 | HTR6 (0.51) | HTR6PNMTALDH1A1HSD17B10CA1 | |
| SCHEMBL1134311 | 0.80 | ENPP2 (0.52) | HTR6ALDH1A1HSD17B10TDP1CA1 | |
| SCHEMBL958043 | 0.80 | ALDH1A1 (0.46) | HTR6ALDH1A1HSD17B10TDP1CA2 | |
| SCHEMBL2326633 | 0.80 | ALDH1A1 (0.46) | HTR6ALDH1A1HSD17B10TDP1CA1 | |
| SCHEMBL3922686 | 0.80 | TSHR (0.57) | HTR6PNMTALDH1A1HSD17B10TDP1 | |
| Hydrochloric Acid SCHEMBL19272459 | 0.80 | CA2 (0.64) | HTR6PNMTCA1CA2ENPP2 | |
| SCHEMBL15299815 | 0.80 | ALDH1A1 (0.46) | HTR6ALDH1A1HSD17B10TDP1CA1 | |
| SCHEMBL3190954 | 0.80 | HTR6 (0.51) | HTR6PNMTCA1CA2ENPP2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111233834-B | FAK-targeting compound and markers thereof, and preparation methods and applications of FAK-targeting compound and markers | 北京师范大学 | 2021-08-31 | — | — | CN | disclosed |
| CN-111233834-A | FAK-targeting compound and markers thereof, and preparation methods and applications of FAK-targeting compound and markers | 北京师范大学 | 2020-06-05 | — | — | CN | disclosed |
| CN-1286812-C | Bispiperidines as antithrombotic agents | LINRAH RES LAB CO LTD (FR) | 2006-11-29 | — | — | CN | disclosed |
| CN-1312799-A | Bispiperidines as antithrombotic agents | L LAB (FR) | 2001-09-12 | — | — | CN | disclosed |