Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 2/20 | 0.50 |
| ▸ | MMP2 | P08253 | 1/20 | 0.49 |
| ▸ | MMP7 | P09237 | 1/20 | 0.49 |
| ▸ | MMP14 | P50281 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.42 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2068996 | 0.98 | FFAR1 (0.51) | FFAR1MMP2MMP7MMP14CA12 | |
| SCHEMBL28541962 | 0.84 | CA12 (0.49) | FFAR1MMP2MMP7MMP14CA12 | |
| SCHEMBL581476 | 0.83 | ALDH1A1 (0.46) | ALDH1A1ALOX12HTTHSD11B1KEAP1 | |
| SCHEMBL5320032 | 0.82 | RECQL (0.61) | ALDH1A1HSD11B1KMT2AMEN1ITGAV | |
| SCHEMBL4924795 | 0.81 | ALDH1A1 (0.53) | CA1CA2CA9ALDH1A1ALOX12 | |
| Hydrazine SCHEMBL28015266 | 0.80 | ALDH1A1 (0.43) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL10514057 | 0.80 | APEX1 (0.64) | ALDH1A1ALOX12HTTHSD11B1KEAP1 | |
| SCHEMBL10581834 | 0.79 | MMP2 (0.50) | FFAR1MMP2MMP7MMP14CA12 | |
| SCHEMBL28922109 | 0.78 | CA12 (0.52) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL17783669 | 0.78 | ALDH1A1 (0.46) | ALDH1A1ALOX12HTTHSD11B1KEAP1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2069452-A | — | — | None | — | — | JP | disclosed |
| JP-H0269452-A | PRODUCTION OF DIIODIDOMETHYL-P-TOLYLSULFONE | MITSUI TOATSU CHEM INC | 1990-03-08 | — | — | JP | disclosed |