Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CAPN1 | P07384 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | CAPN9 | O14815 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | CACNA1B | Q00975 | 10/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CCR1 | P32246 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7300753 | 0.99 | TSHR (0.47) | TSHRCAPN1MAPK1CAPN9CTSB | |
| SCHEMBL10856852 | 0.78 | CAPN1 (0.54) | TSHRCAPN1MAPK1CAPN9CTSB | |
| SCHEMBL10856837 | 0.78 | CAPN1 (0.54) | TSHRCAPN1MAPK1CAPN9CTSB | |
| SCHEMBL10856818 | 0.78 | CAPN1 (0.54) | TSHRCAPN1MAPK1CAPN9CTSB | |
| SCHEMBL7305670 | 0.78 | GAA (0.46) | TSHRCAPN1MAPK1CAPN9CTSB | |
| SCHEMBL7298800 | 0.78 | CAPN1 (0.44) | TSHRCAPN1MAPK1CAPN9CTSB | |
| SCHEMBL7302467 | 0.78 | CAPN1 (0.44) | TSHRCAPN1MAPK1CAPN9CTSB | |
| SCHEMBL7302016 | 0.77 | CAPN1 (0.47) | TSHRCAPN1MAPK1CAPN9CTSB | |
| SCHEMBL7298635 | 0.77 | GAA (0.47) | TSHRCAPN1MAPK1CAPN9CTSB | |
| SCHEMBL14326980 | 0.76 | TSHR (0.52) | TSHRMAPK1CACNA1BKDM4EALDH1A1 |
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-5214056-A | Thiol protease inhibitors | JAPAN TOBACCO INC. (JP) | 1993-05-25 | — | — | US | claimed |
| US-5214056-A | Thiol protease inhibitors | JAPAN TOBACCO INC. (JP) | 1993-05-25 | — | — | US | disclosed |
| EP-0460239-A1 | 1,3,2-DIOXATHIOLANE OXIDE DERIVATIVE | Japan Tobacco Inc. (JP) | 1991-12-11 | — | — | EP | disclosed |