Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.48 |
| ▸ | CA12 | O43570 | 5/20 | 0.48 |
| ▸ | CA1 | P00915 | 5/20 | 0.48 |
| ▸ | CA7 | P43166 | 5/20 | 0.48 |
| ▸ | CA9 | Q16790 | 5/20 | 0.48 |
| ▸ | CA13 | Q8N1Q1 | 4/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | APAF1 | O14727 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 6/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7247052 | 0.86 | ALDH1A1 (0.44) | ALDH1A1CA12CA1CA7CA9 | |
| SCHEMBL7249235 | 0.84 | ALDH1A1 (0.53) | ALDH1A1CA12CA1CA7CA9 | |
| SCHEMBL7246656 | 0.81 | ALDH1A1 (0.51) | ALDH1A1CA12CA1CA7CA9 | |
| SCHEMBL7170109 | 0.81 | ALDH1A1 (0.56) | ALDH1A1CA12CA1CA7CA9 | |
| SCHEMBL7871686 | 0.81 | ALDH1A1 (0.48) | ALDH1A1CA12CA1CA7CA9 | |
| SCHEMBL7871684 | 0.81 | ALDH1A1 (0.48) | ALDH1A1CA12CA1CA7CA9 | |
| SCHEMBL8926859 | 0.70 | ALDH1A1 (0.59) | ALDH1A1CA12CA1CA7CA9 | |
| SCHEMBL13016682 | 0.69 | ALDH1A1 (0.57) | ALDH1A1CA12CA1CA7CA9 | |
| SCHEMBL7033536 | 0.68 | ALDH1A1 (0.59) | ALDH1A1CA12CA1CA7CA9 | |
| SCHEMBL8466791 | 0.68 | ALDH1A1 (0.64) | ALDH1A1CA12CA1CA7CA9 |
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-6313320-B1 | DESULFONATION, DEBLOCKING, DEPROTECTING; VIRICIDES | CHIROTECH TECHNOLOGY, INC. (GB) | 2001-11-06 | — | — | US | disclosed |
| WO-2000064902-A2 | PROCESS FOR THE PREPARATION OF CALANOLIDE PRECURSORS | CHIROTECH TECHNOLOGY LIMITED (GB) | 2000-11-02 | — | — | WO | disclosed |