Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPN | P05981 | 4/20 | 0.52 |
| ▸ | MMP1 | P03956 | 3/20 | 0.45 |
| ▸ | MMP2 | P08253 | 3/20 | 0.45 |
| ▸ | MMP3 | P08254 | 3/20 | 0.45 |
| ▸ | MMP9 | P14780 | 3/20 | 0.45 |
| ▸ | MME | P08473 | 1/20 | 0.45 |
| ▸ | MMP14 | P50281 | 1/20 | 0.45 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.45 |
| ▸ | MMP13 | P45452 | 3/20 | 0.45 |
| ▸ | MMP7 | P09237 | 2/20 | 0.45 |
| ▸ | MMP8 | P22894 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | PLAU | P00749 | 2/20 | 0.42 |
| ▸ | AIMP2 | Q13155 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15705592 | 1.00 | HPN (0.52) | HPNMMP1MMP2MMP3MMP9 | |
| SCHEMBL15711262 | 1.00 | HPN (0.52) | HPNMMP1MMP2MMP3MMP9 | |
| SCHEMBL12871275 | 1.00 | HPN (0.52) | HPNMMP1MMP2MMP3MMP9 | |
| SCHEMBL12871274 | 1.00 | HPN (0.52) | HPNMMP1MMP2MMP3MMP9 | |
| SCHEMBL15711183 | 1.00 | HPN (0.52) | HPNMMP1MMP2MMP3MMP9 | |
| SCHEMBL12871240 | 1.00 | HPN (0.52) | HPNMMP1MMP2MMP3MMP9 | |
| SCHEMBL15705595 | 1.00 | HPN (0.52) | HPNMMP1MMP2MMP3MMP9 | |
| SCHEMBL12871246 | 0.93 | HPN (0.46) | HPNMMP1MMP2MMP3MMP9 | |
| SCHEMBL15705576 | 0.93 | HPN (0.46) | HPNMMP1MMP2MMP3MMP9 | |
| SCHEMBL1175730 | 0.86 | HPN (0.55) | HPNMMP1MMP2MMP3MMP9 |
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 |
|---|---|---|---|---|---|---|---|
| US-9359317-B2 | Small molecule inhibitors of HIV proteases | PURDUE RESEARCH FOUNDATION (US) | 2016-06-07 | — | — | US | disclosed |