Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MMP9 | P14780 | 2/20 | 0.33 |
| ▸ | MMP12 | P39900 | 2/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | STS | P08842 | 4/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | SERPINE1 | P05121 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21961452 | 0.85 | ALDH1A1 (0.38) | MAPTSMN1; SMN2NPSR1ALDH1A1HSD17B10 | |
| SCHEMBL21964588 | 0.81 | HCAR3 (0.40) | ALDH1A1HSD17B10 | |
| SCHEMBL21960919 | 0.77 | L3MBTL3 (0.38) | MEN1NPC1RAB9AKMT2AALDH1A1 | |
| SCHEMBL925233 | 0.67 | MMP9 (0.43) | JMJD6MMP9MMP12MMP1STS | |
| SCHEMBL25291832 | 0.65 | JMJD6 (0.44) | JMJD6MMP9MMP12MMP1STS | |
| SCHEMBL6035336 | 0.65 | ALDH1A1 (0.42) | KMT2ASMN1; SMN2NPSR1ALDH1A1MAPK1 | |
| SCHEMBL25399863 | 0.64 | KMT2A (0.46) | TSHRMAPTMEN1NPC1RAB9A | |
| SCHEMBL343297 | 0.63 | SERPINE1 (0.62) | JMJD6TSHRMMP9MMP12MMP1 | |
| SCHEMBL828645 | 0.63 | NPC1 (0.54) | MMP9MMP12MMP1STSMMP2 | |
| SCHEMBL16344633 | 0.63 | KMT2A (0.48) | TSHRMAPTMEN1NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3478675-B1 | HETEROAROMATIC DERIVATIVES AS NIK INHIBITORS | JANSSEN PHARMACEUTICA NV (BE) | 2020-04-22 | — | — | EP | disclosed |