Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | BACE1 | P56817 | 6/20 | 0.34 |
| ▸ | CTSD | P07339 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7510721 | 0.89 | ALDH1A1 (0.39) | HTR2AHTR2CSLC6A4KMT2AP2RX7 | |
| SCHEMBL13613821 | 0.89 | OPRM1 (0.36) | KMT2ABACE1CTSDOPRL1P2RX7 | |
| SCHEMBL7512649 | 0.86 | KMT2A (0.37) | KMT2ABACE1CTSDMEN1ALDH1A1 | |
| SCHEMBL7512656 | 0.84 | ALDH1A1 (0.46) | KMT2ABACE1CTSDMEN1RAB9A | |
| SCHEMBL7510402 | 0.82 | BACE1 (0.38) | KMT2ABACE1CTSDALDH1A1 | |
| SCHEMBL7518290 | 0.81 | LMNA (0.36) | KMT2AP2RX7MEN1NPC1RAB9A | |
| SCHEMBL7510378 | 0.79 | ALDH1A1 (0.40) | KMT2ABACE1CTSDMEN1RAB9A | |
| SCHEMBL10144298 | 0.79 | BACE1 (0.33) | BACE1CTSD | |
| SCHEMBL17551756 | 0.78 | KMT2A (0.34) | KMT2ABACE1CTSDMEN1ALDH1A1 | |
| SCHEMBL12504790 | 0.76 | BACE1 (0.35) | KMT2ABACE1CTSD |
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-8178513-B2 | Heterocyclic aspartyl protease inhibitors | SCHERING CORPORATION (US) | 2012-05-15 | — | — | US | disclosed |