Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | CUL4A | Q13619 | 1/20 | 0.48 |
| ▸ | UCHL1 | P09936 | 2/20 | 0.48 |
| ▸ | UCHL3 | P15374 | 2/20 | 0.48 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.46 |
| ▸ | PIN4 | Q9Y237 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.41 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.41 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9177631 | 1.00 | ALDH1A1 (0.54) | ALDH1A1CUL4AUCHL1UCHL3PIN1 | |
| SCHEMBL6316299 | 0.88 | ALDH1A1 (0.56) | ALDH1A1CUL4AUCHL1UCHL3PIN1 | |
| SCHEMBL6316296 | 0.88 | ALDH1A1 (0.56) | ALDH1A1CUL4AUCHL1UCHL3PIN1 | |
| SCHEMBL12674685 | 0.83 | ALDH1A1 (0.76) | ALDH1A1CUL4APIN1PIN4RXFP1 | |
| SCHEMBL6319755 | 0.82 | ALDH1A1 (0.46) | ALDH1A1PIN1PIN4RXFP1MAPT | |
| SCHEMBL6323847 | 0.82 | ALDH1A1 (0.46) | ALDH1A1PIN1PIN4RXFP1MAPT | |
| SCHEMBL6316140 | 0.79 | ALDH1A1 (0.55) | ALDH1A1UCHL1UCHL3CES1MAPT | |
| SCHEMBL6316144 | 0.79 | ALDH1A1 (0.55) | ALDH1A1UCHL1UCHL3CES1MAPT | |
| SCHEMBL522944 | 0.76 | PIN1 (0.68) | ALDH1A1PIN1PIN4RXFP1MAPT | |
| SCHEMBL30892347 | 0.74 | UCHL1 (0.42) | ALDH1A1CUL4AUCHL1UCHL3CES1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0432648-B1 | Isatine derivatives, their preparation and use | NEUROSEARCH AS (DK) | 1995-08-02 | — | — | EP | disclosed |
| US-5198461-A | Isatine derivatives, their preparation and use | NEUROSEARCH A/S (DK) | 1993-03-30 | — | — | US | disclosed |
| EP-0432648-A2 | Isatine derivatives, their preparation and use | NEUROSEARCH A/S (DK) | 1991-06-19 | — | — | EP | disclosed |