Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | METAP2 | P50579 | 1/20 | 0.44 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL3381004 | 0.89 | BCAT2 (0.42) | BCAT2KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL5685798 | 0.86 | EPHX1 (0.44) | BCAT2KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL474162 | 0.82 | KDM4E (0.45) | BCAT2KDM4EALDH1A1MAPTTSHR | |
| Carbamic Acid SCHEMBL8718091 | 0.82 | BCAT2 (0.38) | BCAT2KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL15524386 | 0.82 | ALDH1A1 (0.52) | KDM4EALDH1A1MAPTHSD17B10HPGD | |
| SCHEMBL3380036 | 0.81 | IRAK4 (0.47) | BCAT2KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL5134567 | 0.79 | KDM4E (0.50) | BCAT2KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL29000137 | 0.78 | BCAT2 (0.44) | BCAT2KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL31632660 | 0.77 | IRAK4 (0.55) | BCAT2KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL105262 | 0.77 | IRAK4 (0.55) | BCAT2KDM4EALDH1A1MAPTTSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-2699551-A1 | TETRAHYDROQUINOLINE DERIVATIVES USEFUL AS BROMODOMAIN INHIBITORS | Glaxosmithkline LLC (US) | 2014-02-26 | — | — | EP | disclosed |
| WO-2012143415-A1 | TETRAHYDROQUINOLINE DERIVATIVES USEFUL AS BROMODOMAIN INHIBITORS | GLAXOSMITHKLINE LLC (US) | 2012-10-26 | — | — | WO | disclosed |