Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FTO | Q9C0B1 | 5/20 | 0.50 |
| ▸ | KDM6B | O15054 | 2/20 | 0.50 |
| ▸ | ALKBH2 | Q6NS38 | 1/20 | 0.50 |
| ▸ | ALKBH3 | Q96Q83 | 1/20 | 0.50 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.50 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.50 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | LSS | P48449 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9868800 | 0.88 | KDM6B (0.41) | FTOKDM6BALKBH2ALKBH3KDM5B | |
| SCHEMBL9870443 | 0.83 | FTO (0.52) | FTOKDM6BALKBH2ALKBH3KDM5B | |
| SCHEMBL6491004 | 0.82 | FTO (0.56) | FTOKDM6BALKBH2ALKBH3KDM5B | |
| SCHEMBL7020791 | 0.81 | TSHR (0.49) | PKMALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL258224 | 0.76 | KDM6B (0.59) | FTOKDM6BALKBH2ALKBH3KDM5B | |
| SCHEMBL9869425 | 0.74 | CYP11B1 (0.48) | FTOCYP11B1CYP11B2PKMALDH1A1 | |
| SCHEMBL9870441 | 0.74 | FTO (0.56) | FTOKDM6BALKBH2ALKBH3KDM5B | |
| SCHEMBL9868870 | 0.73 | FTO (0.53) | FTOKDM6BALKBH2ALKBH3KDM5B | |
| SCHEMBL9869588 | 0.73 | CYP11B1 (0.45) | FTOKDM6BALKBH2ALKBH3KDM5B | |
| SCHEMBL8072878 | 0.72 | KDM6B (0.46) | FTOKDM6BALKBH2ALKBH3KDM5B |
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-5006532-A | Enzyme inhibitor; antiinflammatory agents | MERCK & CO. INC., INC. (US) | 1991-04-09 | — | — | US | disclosed |
| US-4904672-A | Derivatives of 3-hydroxyazabenzo[b]thiophene useful as 5-lipoxygenase inhibitors | MERCK & CO., INC. (US) | 1990-02-27 | — | — | US | disclosed |
| US-4767766-A | Derivatives of 3-hydroxyazabenzo(B)thiophene useful as 5-lipoxygenase inhibitors | MERCK & CO., INC. (US) | 1988-08-30 | — | — | US | disclosed |