Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | GOT1 | P17174 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MPO | P05164 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | THPO | P40225 | 1/20 | 0.46 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.46 |
| ▸ | ACOX1 | Q15067 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1673296 | 0.83 | KDM4E (0.55) | KDM4ECYP3A4NPC1RAB9ALMNA | |
| SCHEMBL30523852 | 0.83 | KDM4E (0.55) | KDM4ECYP3A4NPC1RAB9ALMNA | |
| SCHEMBL29710429 | 0.81 | KDM4E (0.45) | KDM4ECYP3A4NPC1RAB9ALMNA | |
| SCHEMBL7507036 | 0.81 | KDM4E (0.45) | KDM4ECYP3A4NPC1RAB9ALMNA | |
| SCHEMBL13911023 | 0.79 | KDM4E (0.52) | KDM4ECYP3A4NPC1RAB9ALMNA | |
| SCHEMBL314686 | 0.77 | NPC1 (0.46) | KDM4ECYP3A4NPC1RAB9ALMNA | |
| SCHEMBL1268508 | 0.76 | KDM4E (0.48) | KDM4ECYP3A4NPC1RAB9ALMNA | |
| SCHEMBL29816494 | 0.76 | KDM4E (0.48) | KDM4ECYP3A4NPC1RAB9ALMNA | |
| SCHEMBL28657632 | 0.74 | KDM4E (0.47) | KDM4ECYP3A4NPC1RAB9ALMNA | |
| SCHEMBL4724567 | 0.74 | NISCH (0.44) | KDM4ECYP3A4NPC1RAB9ALMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105814022-A | Fused bicyclic heteroaromatic derivatives as modulators of tnf activity | UCB生物制药私人有限公司 | 2016-07-27 | — | — | CN | disclosed |
| CN-105814056-A | Purine derivatives as modulators of TNF activity | UCB生物制药私人有限公司 | 2016-07-27 | — | — | CN | disclosed |