Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TYR | P14679 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1843380 | 0.98 | TSHR (0.46) | TSHRALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL7286991 | 0.95 | TSHR (0.44) | TSHRALDH1A1HPGDALOX15HSD17B10 | |
| Thioglycolic Acid SCHEMBL10902565 | 0.81 | CYP2C19 (0.42) | ALDH1A1HPGDALOX15HSD17B10TDP1 | |
| SCHEMBL20331 | 0.81 | TSHR (0.44) | TSHRALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL179803 | 0.80 | ALDH1A1 (0.46) | TSHRALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL29403104 | 0.80 | ALDH1A1 (0.46) | TSHRALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL22014970 | 0.79 | ESR1 (0.40) | TSHRALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL8872437 | 0.78 | ALDH1A1 (0.44) | TSHRALDH1A1HPGDALOX15HSD17B10 | |
| SCHEMBL20994072 | 0.78 | PDE2A (0.43) | TSHRMEN1MAPTKMT2AKIF11 | |
| SCHEMBL7086864 | 0.76 | ALDH1A1 (0.43) | TSHRALDH1A1HPGDALOX15HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-6359138-B1 | CENTRAL NERVOUS SYSTEM DISORDERS | HOFFMANN-LA ROCHE INC. | 2002-03-19 | — | — | US | disclosed |
| EP-0846683-B1 | 4-Hydroxy-piperidine derivatives | HOFFMANN LA ROCHE (CH) | 2001-09-19 | — | — | EP | disclosed |
| EP-0846683-A1 | 4-Hydroxy-piperidine derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1998-06-10 | — | — | EP | disclosed |