Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | TNF | P01375 | 2/20 | 0.46 |
| ▸ | TLR2 | O60603 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.41 |
| ▸ | FABP5 | Q01469 | 3/20 | 0.40 |
| ▸ | FABP7 | O15540 | 2/20 | 0.40 |
| ▸ | PTGES | O14684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21182260 | 0.93 | KDM4E (0.46) | KMT2ATNFTLR2KDM4ETSHR | |
| SCHEMBL16773475 | 0.87 | TLR2 (0.46) | KMT2ATNFTLR2FABP5FABP7 | |
| SCHEMBL16360194 | 0.87 | KMT2A (0.54) | KMT2ATNFTLR2FABP5FABP7 | |
| SCHEMBL27984222 | 0.87 | KMT2A (0.54) | KMT2ATNFTLR2FABP5FABP7 | |
| Hydrochloric Acid SCHEMBL28086829 | 0.85 | KMT2A (0.53) | KMT2ATNFTLR2FABP5FABP7 | |
| SCHEMBL14612149 | 0.85 | KMT2A (0.52) | KMT2ATNFTLR2FABP5FABP7 | |
| SCHEMBL10071038 | 0.84 | KMT2A (0.50) | KMT2ATNFTLR2KDM4EFABP5 | |
| SCHEMBL14759878 | 0.83 | KMT2A (0.60) | KMT2ATNFFABP5FABP7 | |
| SCHEMBL14237194 | 0.82 | KMT2A (0.51) | KMT2ATNFTLR2HDAC1HDAC2 | |
| SCHEMBL7705059 | 0.82 | KMT2A (0.51) | KMT2ATNFTLR2HDAC1HDAC2 |
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-7179918-B2 | HIV protease inhibitors, compositions containing the same, their pharmaceutical uses and materials for their synthesis | AGOURON PHARMACEUTICALS, INC. (US) | 2007-02-20 | — | — | US | disclosed |