Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.50 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | ANPEP | P15144 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12366133 | 0.81 | HPGD (0.54) | KMT2ANPC1RAB9AMAPTRIPK1 | |
| SCHEMBL12366141 | 0.81 | NPC1 (0.62) | KMT2ANPC1RAB9AALDH1A1LMNA | |
| SCHEMBL12366090 | 0.81 | ALDH1A1 (0.57) | KMT2ANPC1RAB9AP2RX7ALDH1A1 | |
| SCHEMBL12366196 | 0.78 | KMT2A (0.58) | KMT2AMAPTP2RX7CA2LMNA | |
| SCHEMBL2905338 | 0.78 | RIPK1 (0.62) | KMT2ANPC1RAB9AMAPTRIPK1 | |
| SCHEMBL30259906 | 0.78 | RIPK1 (0.62) | KMT2ANPC1RAB9AMAPTRIPK1 | |
| SCHEMBL12366112 | 0.77 | EPHX2 (0.51) | KMT2AP2RX7MEN1 | |
| SCHEMBL11591975 | 0.76 | GAA (0.59) | KMT2ARAB9AMAPTALDH1A1LMNA | |
| SCHEMBL2456852 | 0.75 | KMT2A (0.58) | KMT2ANPC1RAB9AMAPTRIPK1 | |
| SCHEMBL12366179 | 0.75 | P2RX7 (0.46) | KMT2ANPC1RAB9ARIPK1P2RX7 |
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-7998986-B2 | Heterocyclic compounds, in particular N-substituted pyridones for modulating the activity of nuclear receptors | EXELIXIS PATENT COMPANY LLC (US) | 2011-08-16 | — | — | US | disclosed |