Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 9/20 | 0.37 |
| ▸ | MMP13 | P45452 | 5/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | MMP9 | P14780 | 6/20 | 0.35 |
| ▸ | MMP2 | P08253 | 6/20 | 0.35 |
| ▸ | MMP7 | P09237 | 2/20 | 0.34 |
| ▸ | MMP3 | P08254 | 2/20 | 0.34 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL7985326 | 0.78 | MMP1 (0.37) | ALDH1A1KMT2AMAPK1MMP1MMP13 | |
| SCHEMBL7985329 | 0.66 | MMP1 (0.43) | ALDH1A1MEN1KMT2AMMP1MMP13 | |
| SCHEMBL7984313 | 0.66 | HTT (0.49) | MEN1KMT2AMMP1MMP13MMP9 | |
| SCHEMBL7984321 | 0.66 | HTT (0.49) | MEN1KMT2AMMP1MMP13MMP9 | |
| SCHEMBL28270090 | 0.62 | PKM (0.50) | ALDH1A1MMP1MMP13MMP9MMP2 | |
| SCHEMBL4596857 | 0.60 | KMT2A (0.44) | MEN1KMT2A | |
| SCHEMBL11562012 | 0.59 | F2 (0.54) | ALDH1A1MMP1MMP13MMP9MMP2 | |
| SCHEMBL7077429 | 0.59 | HTT (0.52) | MEN1KMT2AMMP1MMP13MMP9 | |
| SCHEMBL7212138 | 0.58 | MMP13 (0.54) | MMP1MMP13MMP9MMP2MMP3 | |
| SCHEMBL13043584 | 0.58 | MMP1 (0.85) | MMP1MMP13MMP9MMP2MMP3 |
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 |