Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 5/20 | 0.49 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.42 |
| ▸ | CHUK | O15111 | 2/20 | 0.40 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.40 |
| ▸ | PKMYT1 | Q99640 | 1/20 | 0.40 |
| ▸ | MAP2K3 | P46734 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | FABP4 | P15090 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3763563 | 0.78 | FABP4 (0.43) | IKBKBBCAT2CHUKKDM4EHSD17B10 | |
| SCHEMBL4681806 | 0.77 | BCAT2 (0.41) | IKBKBBCAT2CHUKKDM4EHSD17B10 | |
| SCHEMBL5131382 | 0.77 | KMT2A (0.46) | IKBKBBCAT2KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL4776531 | 0.75 | FABP4 (0.46) | IKBKBBCAT2CHUKIKBKEPKMYT1 | |
| SCHEMBL27727318 | 0.75 | BCAT2 (0.39) | IKBKBBCAT2CHUKKDM4EHSD17B10 | |
| SCHEMBL2832469 | 0.74 | BCAT2 (0.62) | IKBKBBCAT2CHUKIKBKEPKMYT1 | |
| SCHEMBL4151580 | 0.73 | BCAT2 (0.59) | IKBKBBCAT2KDM4EHSD17B10ALDH1A1 | |
| SCHEMBL407835 | 0.73 | BCAT2 (0.55) | IKBKBBCAT2MAP2K3KDM4EHSD17B10 | |
| SCHEMBL29712321 | 0.73 | BCAT2 (0.55) | IKBKBBCAT2MAP2K3KDM4EHSD17B10 | |
| SCHEMBL24129924 | 0.72 | L3MBTL1 (0.44) | KDM4EHSD17B10ALDH1A1HPGDCYP3A4 |
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-102573994-B | Novel bicyclic urea compounds | MERCK PATENT GMBH | 2015-06-24 | — | — | CN | claimed |
| CN-102573994-B | Novel bicyclic urea compounds | MERCK PATENT GMBH | 2015-06-24 | — | — | CN | disclosed |