Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 3/20 | 0.40 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.38 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.37 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.35 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.35 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.35 |
| ▸ | ESRRB | O95718 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESRRA | P11474 | 1/20 | 0.35 |
| ▸ | ESRRG | P62508 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17595142 | 0.90 | ABCB1 (0.39) | ABCB1DDB1CRBNMAPTALDH1A1 | |
| SCHEMBL14746007 | 0.90 | MAPT (0.45) | ABCB1DDB1CRBNMAPTALDH1A1 | |
| SCHEMBL14745432 | 0.87 | MAPT (0.47) | DDB1CRBNMAPTALDH1A1LMNA | |
| SCHEMBL17594868 | 0.84 | KIF11 (0.38) | ALDH1A1LMNA | |
| SCHEMBL17594969 | 0.83 | KIF11 (0.39) | ALDH1A1LMNAMEN1KMT2AHTT | |
| SCHEMBL14758613 | 0.83 | TLR9 (0.42) | ABCB1ALDH1A1CTSSTLR9TLR8 | |
| SCHEMBL17595028 | 0.81 | ALDH1A1 (0.42) | DDB1CRBNMAPTALDH1A1LMNA | |
| SCHEMBL14745182 | 0.81 | KHK (0.42) | ALDH1A1CTSSCTSKTLR9TLR8 | |
| Trifluoroacetic Acid SCHEMBL14745045 | 0.79 | TLR9 (0.39) | ABCB1ALDH1A1CTSSCTSKTLR9 | |
| Trifluoroacetic Acid SCHEMBL14744879 | 0.76 | KHK (0.39) | ALDH1A1LMNACTSSCTSKTLR9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016039936-A2 | MONOCYCLIC SUBSTITUTED 2-PYRIDINONE ANTIBACTERIAL COMPOUNDS | PTC THERAPEUTICS, INC. (US) | 2016-03-17 | — | — | WO | claimed |