Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL10178487 | 0.82 | ALDH1A1 (0.42) | ALDH1A1HPGDUSP2GAAPKM | |
| SCHEMBL10178491 | 0.80 | HTR2A (0.39) | ALDH1A1HPGDUSP2GAAPKM | |
| SCHEMBL27348755 | 0.79 | ALDH1A1 (0.35) | ALDH1A1HPGDUSP2GAAPKM | |
| SCHEMBL4106407 | 0.79 | TDP1 (0.47) | ALDH1A1HPGDCYP2C9 | |
| SCHEMBL10178574 | 0.79 | ALDH1A1 (0.40) | ALDH1A1HPGDUSP2GAAPKM | |
| SCHEMBL10178571 | 0.79 | ALDH1A1 (0.40) | ALDH1A1HPGDUSP2GAAPKM | |
| SCHEMBL10017779 | 0.76 | CA2 (0.46) | ALDH1A1HPGDUSP2GAAPKM | |
| SCHEMBL10178552 | 0.76 | ALDH1A1 (0.43) | ALDH1A1HPGDUSP2GAAPKM | |
| SCHEMBL14573186 | 0.76 | ALDH1A1 (0.33) | ALDH1A1HPGDGAATSHRCYP2C9 | |
| SCHEMBL357876 | 0.75 | ESR1 (0.47) | ALDH1A1HPGDUSP2GAAPKM |
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-7183367-B2 | Vinyl sulphone modified polymer | N.V. ORGANON (NL) | 2007-02-27 | — | — | US | disclosed |