Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.41 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.39 |
| ▸ | HTR5A | P47898 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3492874 | 0.78 | CA12 (0.56) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL8286615 | 0.78 | CA12 (0.56) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL3390541 | 0.76 | ALDH1A1 (0.42) | CA12CA1CA2CA9HSD17B10 | |
| SCHEMBL1522527 | 0.74 | HSD17B10 (0.37) | CA12CA1CA2CA9HSD17B10 | |
| SCHEMBL4649502 | 0.73 | CXCR2 (0.69) | CXCR2HTR7 | |
| SCHEMBL31154113 | 0.72 | HSD17B10 (0.49) | CA12CA1CA2CA9HSD17B10 | |
| SCHEMBL4687630 | 0.70 | CA12 (0.64) | CA12CA1CA2CA9 | |
| SCHEMBL10118553 | 0.69 | CA12 (1.00) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL2573400 | 0.68 | HSD17B10 (0.48) | CA1CA2CA9HSD17B10ALDH1A1 | |
| SCHEMBL4129036 | 0.68 | HSD17B10 (0.48) | CA1CA2CA9HSD17B10ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005058348-A1 | USE OF CATHEPSIN S INHIBITORS FOR TREATING AN IMMUNE RESPONSE CAUSED BY ADMINISTRATION OF A SMALL MOLECULE THERAPEUTIC OR BIOLOGIC | AXYS PHARMACEUTICALS, INC. (US) | 2005-06-30 | — | — | WO | disclosed |