Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.63 |
| ▸ | NPC1 | O15118 | 5/20 | 0.63 |
| ▸ | HIF1A | Q16665 | 5/20 | 0.59 |
| ▸ | EPAS1 | Q99814 | 5/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.54 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.54 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.54 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL15235768 | 0.96 | RAB9A (0.60) | RAB9ANPC1HIF1AEPAS1SMN1; SMN2 | |
| SCHEMBL3017442 | 0.79 | KMT2A (0.65) | RAB9ANPC1SMN1; SMN2ALDH1A1KMT2A | |
| SCHEMBL255145 | 0.79 | MMP13 (0.57) | HIF1AEPAS1ALDH1A1 | |
| SCHEMBL27805648 | 0.78 | MMP13 (0.56) | — | |
| SCHEMBL254974 | 0.77 | MAPK1 (0.70) | RAB9AHIF1AEPAS1SMN1; SMN2MAPK1 | |
| SCHEMBL13244739 | 0.75 | MMP13 (0.52) | — | |
| SCHEMBL14715273 | 0.75 | MMP13 (0.56) | HIF1AEPAS1ALDH1A1 | |
| SCHEMBL28053121 | 0.75 | KMT2A (0.51) | HIF1AEPAS1KMT2A | |
| SCHEMBL24728688 | 0.75 | HIF1A (0.68) | RAB9ANPC1HIF1AEPAS1SMN1; SMN2 | |
| SCHEMBL13244851 | 0.75 | HIF1A (0.52) | HIF1AEPAS1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012031298-A2 | ETHYNYLBENZENE DERIVATIVES | DUKE UNIVERSITY (US) | 2012-03-08 | — | — | WO | disclosed |