Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.68 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA3 | P07451 | 1/20 | 0.37 |
| ▸ | CA6 | P23280 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 2/20 | 0.33 |
| ▸ | GRIA1 | P42261 | 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 | |
|---|---|---|---|---|
| SCHEMBL12062511 | 0.82 | — | — | |
| SCHEMBL59271 | 0.82 | — | — | |
| SCHEMBL12061418 | 0.82 | — | — | |
| SCHEMBL8863287 | 0.78 | TSHR (0.90) | TSHRALDH1A1 | |
| SCHEMBL20676885 | 0.78 | TSHR (0.90) | TSHRALDH1A1 | |
| SCHEMBL28717798 | 0.77 | TSHR (0.63) | TSHRALDH1A1MEN1KMT2A | |
| SCHEMBL3945082 | 0.73 | CYP2A6 (0.54) | TSHRCYP2A6ALDH1A1LOXL2CA12 | |
| SCHEMBL29110898 | 0.71 | TSHR (0.74) | TSHR | |
| SCHEMBL3622038 | 0.71 | — | — | |
| SCHEMBL7209548 | 0.69 | TSHR (0.71) | TSHRALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4628077-A | Preparation of polyamide with catalyst comprising transition metal attached to a ligand which contains electron withdrawing groups | THE STANDARD OIL COMPANY (US) | 1986-12-09 | — | — | US | disclosed |
| US-4625002-A | Binuclear catalyst for the preparation of polyamide | THE STANDARD OIL COMPANY (US) | 1986-11-25 | — | — | US | disclosed |