Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL12366100 | 0.82 | ALDH1A1 (0.56) | NPC1MEN1KMT2ALMNAPOLB | |
| SCHEMBL24270281 | 0.80 | KMT2A (0.53) | NR1H4CA1CA2NPC1MEN1 | |
| SCHEMBL15290436 | 0.80 | NR1H4 (0.50) | NR1H4CA12CA1CA2CA7 | |
| SCHEMBL12366093 | 0.80 | MMP13 (0.52) | NPC1LMNAPOLBTP53ALDH1A1 | |
| SCHEMBL12773624 | 0.79 | NR1H4 (0.53) | NR1H4CA12CA1CA2CA7 | |
| SCHEMBL12366188 | 0.79 | LMNA (0.47) | CA12CA1CA2CA7KMT2A | |
| SCHEMBL12366164 | 0.78 | TSHR (0.58) | MEN1KMT2ALMNAPOLBTP53 | |
| SCHEMBL12366168 | 0.78 | P2RX7 (0.44) | MEN1KMT2ALMNAALDH1A1GAA | |
| SCHEMBL585949 | 0.78 | NR1H4 (0.58) | NR1H4CA12CA1CA2CA7 | |
| SCHEMBL12366175 | 0.77 | NPC1 (0.56) | NPC1MEN1KMT2AHTTLMNA |
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 |