Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | TSHR | P16473 | 5/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.36 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.36 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.36 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | G6PD | P11413 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5203798 | 0.87 | CYP1A2 (0.56) | CYP1A2ALDH1A1TSHRCYP3A4RECQL | |
| Pyridazine SCHEMBL6680189 | 0.78 | CYP1A2 (0.46) | CYP1A2ALDH1A1TSHRCYP3A4RECQL | |
| SCHEMBL11598706 | 0.76 | POLB (0.49) | CYP1A2ALDH1A1TSHRCYP3A4RECQL | |
| SCHEMBL1828689 | 0.76 | TSHR (0.48) | CYP1A2ALDH1A1TSHRCYP3A4RECQL | |
| SCHEMBL6671674 | 0.74 | CYP1A2 (0.52) | CYP1A2ALDH1A1TSHRCYP3A4RECQL | |
| SCHEMBL5202894 | 0.74 | CYP1A2 (0.52) | CYP1A2ALDH1A1TSHRCYP3A4RECQL | |
| Methyl Alcohol SCHEMBL11328895 | 0.74 | POLB (0.46) | CYP1A2ALDH1A1TSHRCYP3A4RECQL | |
| SCHEMBL19230478 | 0.73 | CYP1A2 (0.60) | CYP1A2ALDH1A1TSHRCYP3A4RECQL | |
| SCHEMBL9793418 | 0.73 | GRIN2D (0.46) | CYP1A2ALDH1A1TSHRCYP3A4RECQL | |
| SCHEMBL7558393 | 0.72 | HCAR3 (0.42) | CYP1A2ALDH1A1TSHRCYP3A4GRIN2D |
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 |
|---|---|---|---|---|---|---|---|
| JP-3587913-B2 | Bag made of polyamide and its manufacturing method and bag-in-box | — | 2004-11-10 | — | — | JP | disclosed |