Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 2/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11235235 | 0.94 | PKM (0.53) | PKMCYP3A4KDM4ECA1CA2 | |
| SCHEMBL11035439 | 0.86 | PKM (0.43) | PKMCYP3A4KDM4ECA1CA2 | |
| SCHEMBL11239581 | 0.80 | MAPT (0.46) | PKMCYP3A4CA1CA2MMP1 | |
| SCHEMBL11500453 | 0.80 | CA2 (0.56) | CA1CA2MMP1MMP2MMP9 | |
| Acetoacetic Acid SCHEMBL11225443 | 0.78 | PKM (0.45) | PKMCYP3A4KDM4ECA1CA2 | |
| SCHEMBL11500997 | 0.75 | CA12 (0.35) | PKMCYP3A4KDM4ECA1CA2 | |
| SCHEMBL11500845 | 0.74 | NSD2 (0.36) | KDM4ECA1CA2GAAALDH1A1 | |
| SCHEMBL11501002 | 0.74 | GAA (0.43) | CA1CA2GAAALDH1A1F2 | |
| Acetoacetic Acid SCHEMBL11235223 | 0.72 | PKM (0.53) | PKMKDM4ECA1CA2MMP1 | |
| SCHEMBL4649818 | 0.72 | PKM (0.59) | PKMCYP3A4KDM4ECA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4348204-A | COTTON, REGENERATED CELLULOSE, PAPER; TETRAKISAZO DYES | CASSELLA AKTIENGESELLSCHAFT (DE) | 1982-09-07 | — | — | US | disclosed |