Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 1/20 | 0.46 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.46 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | PPIB | P23284 | 2/20 | 0.39 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.39 |
| ▸ | MLNR | O43193 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.37 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8581201 | 0.84 | KMT2A (0.50) | NR1H4EGFRERBB2MAOAHTT | |
| SCHEMBL2127770 | 0.84 | KMT2A (0.50) | NR1H4EGFRERBB2MAOAHTT | |
| Cyclopropane SCHEMBL28215074 | 0.82 | LOXL2 (0.54) | NR1H4EGFRERBB2LOXL2HTT | |
| SCHEMBL7046909 | 0.81 | KMT2A (0.54) | NR1H4EGFRERBB2MAOAHTT | |
| SCHEMBL12812295 | 0.79 | KDM4E (0.59) | NR1H4EGFRERBB2LOXL2MAOA | |
| SCHEMBL13973193 | 0.78 | TRPV1 (0.56) | NR1H4KDM4ETRPV1 | |
| SCHEMBL7406735 | 0.78 | HSD17B1 (0.50) | NR1H4EGFRERBB2MAOAHTT | |
| SCHEMBL1749595 | 0.77 | MCHR1 (0.50) | EGFRERBB2HIF1AMAOAHTT | |
| SCHEMBL7410067 | 0.76 | CHEK2 (0.49) | NR1H4EGFRERBB2MAOAHTT | |
| SCHEMBL7373511 | 0.76 | KMT2A (0.64) | EGFRERBB2MAOAHTTHDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108026039-A | New carbocyclic compound as ROR gamma modulators | 格兰马克药品股份有限公司 | 2018-05-11 | — | — | CN | disclosed |