Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.70 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.70 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.70 |
| ▸ | HPGD | P15428 | 1/20 | 0.70 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.70 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | TYR | P14679 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29416834 | 0.88 | CA2 (0.52) | ALDH1A1ALOX15HSD17B10HPGDTDP1 | |
| SCHEMBL247483 | 0.88 | CA2 (0.52) | ALDH1A1ALOX15HSD17B10HPGDTDP1 | |
| Catechol SCHEMBL27199175 | 0.87 | ALDH1A1 (0.52) | ALDH1A1ALOX15HSD17B10HPGDTDP1 | |
| SCHEMBL30718926 | 0.86 | CA2 (0.50) | ALDH1A1ALOX15HSD17B10HPGDTDP1 | |
| SCHEMBL28135995 | 0.86 | CA2 (0.50) | ALDH1A1ALOX15HSD17B10HPGDTDP1 | |
| SCHEMBL8170388 | 0.85 | ALDH1A1 (0.57) | ALDH1A1ALOX15HSD17B10HPGDTDP1 | |
| SCHEMBL50705 | 0.84 | ALDH1A1 (1.00) | ALDH1A1ALOX15HSD17B10HPGDTDP1 | |
| SCHEMBL29358687 | 0.84 | ALDH1A1 (1.00) | ALDH1A1ALOX15HSD17B10HPGDTDP1 | |
| Boric Acid SCHEMBL27556736 | 0.82 | CA2 (0.46) | ALDH1A1ALOX15HSD17B10HPGDTDP1 | |
| SCHEMBL3458467 | 0.82 | ALDH1A1 (0.66) | ALDH1A1ALOX15HSD17B10HPGDTDP1 |
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-4424381-A | COMPLEXING WITH GROUP 2A METAL HALIDE | KOPPERS COMPANY, INC. (US) | 1984-01-03 | — | — | US | disclosed |