Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 7/20 | 0.43 |
| ▸ | MMP2 | P08253 | 7/20 | 0.43 |
| ▸ | PLA2G7 | Q13093 | 2/20 | 0.40 |
| ▸ | MMP9 | P14780 | 3/20 | 0.40 |
| ▸ | MMP3 | P08254 | 3/20 | 0.39 |
| ▸ | MMP13 | P45452 | 3/20 | 0.39 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7984313 | 0.76 | HTT (0.49) | MMP1MMP2MMP9MMP13HTT | |
| SCHEMBL7984321 | 0.76 | HTT (0.49) | MMP1MMP2MMP9MMP13HTT | |
| SCHEMBL7985326 | 0.75 | MMP1 (0.37) | MMP1MMP2MMP9MMP3MMP13 | |
| SCHEMBL7985260 | 0.69 | PLA2G7 (0.36) | MMP1MMP2PLA2G7MMP9MMP3 | |
| SCHEMBL7985333 | 0.66 | ALDH1A1 (0.38) | MMP1MMP2MMP9MMP3MMP13 | |
| SCHEMBL7210792 | 0.66 | MMP1 (0.43) | MMP1MMP2MMP9MMP3MMP13 | |
| SCHEMBL7078071 | 0.64 | MMP2 (0.58) | MMP1MMP2PLA2G7MMP9MMP3 | |
| SCHEMBL6349930 | 0.63 | APEX1 (0.46) | HTTHSD17B10MEN1KMT2AALDH1A1 | |
| SCHEMBL6349926 | 0.63 | APEX1 (0.46) | HTTHSD17B10MEN1KMT2AALDH1A1 | |
| SCHEMBL7603860 | 0.62 | PLA2G7 (0.40) | MMP1MMP2PLA2G7MMP9MMP3 |
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-6274758-B1 | ENANTIOMORPH SELECTIVITY | DARWIN DISCOVERY, LTD. (GB) | 2001-08-14 | — | — | US | disclosed |
| EP-1017650-A1 | ASYMMETRIC HYDROGENATION | Darwin Discovery Limited (GB) | 2000-07-12 | — | — | EP | disclosed |
| WO-1999015481-A1 | ASYMMETRIC HYDROGENATION | DARWIN DISCOVERY LIMITED (GB) | 1999-04-01 | — | — | WO | disclosed |