Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 7/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | KIT | P10721 | 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 | |
|---|---|---|---|---|
| SCHEMBL28064841 | 1.00 | ALDH1A1 (0.44) | ALDH1A1MEN1GAAMAPTHPGD | |
| SCHEMBL7680686 | 0.88 | ALDH1A1 (0.46) | ALDH1A1MEN1GAAMAPTHPGD | |
| SCHEMBL12682263 | 0.78 | DRD2 (0.46) | ALDH1A1GAAMAPTKMT2AMTNR1B | |
| SCHEMBL2571280 | 0.78 | SRD5A1 (0.48) | MTNR1BGPR84MTNR1A | |
| SCHEMBL2572769 | 0.78 | SRD5A1 (0.48) | MTNR1BGPR84MTNR1A | |
| SCHEMBL2571011 | 0.78 | SRD5A1 (0.48) | MTNR1BGPR84MTNR1A | |
| SCHEMBL12682243 | 0.78 | SRD5A1 (0.48) | MTNR1BGPR84MTNR1A | |
| SCHEMBL2573895 | 0.76 | ABL1 (0.44) | ALDH1A1MTNR1BMTNR1AABL1PDGFRB | |
| SCHEMBL2576042 | 0.76 | ABL1 (0.44) | ALDH1A1MTNR1BMTNR1AABL1PDGFRB | |
| SCHEMBL2575580 | 0.76 | ABL1 (0.44) | ALDH1A1MTNR1BMTNR1AABL1PDGFRB |
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 |
|---|---|---|---|---|---|---|---|
| CN-103370324-B | As aryne analog derivative and the medical application thereof of kinases inhibitor | SUN SHUPING (CN) | 2016-05-18 | — | — | CN | disclosed |