Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | ECE1 | P42892 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL11055546 | 0.89 | SLC6A4 (0.37) | SLC6A4HSD17B10CYP3A4TSHRTGFBR1 | |
| SCHEMBL17604 | 0.86 | — | — | |
| SCHEMBL1888688 | 0.86 | — | — | |
| Formaldehyde SCHEMBL15901632 | 0.84 | SLC6A4 (0.39) | SLC6A4HSD17B10TSHRKMT2AMEN1 | |
| Water SCHEMBL2898635 | 0.84 | — | — | |
| Ammonia Solution, Strong SCHEMBL1170675 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL15284044 | 0.84 | — | — | |
| Monoethanolamine SCHEMBL10839687 | 0.82 | TSHR (0.38) | SLC6A4HSD17B10TSHRKMT2AALDH1A1 | |
| Methacrylic Acid SCHEMBL3447868 | 0.82 | TGFBR1 (0.39) | SLC6A4HSD17B10CYP3A4TSHRTGFBR1 | |
| Sulfuric Acid SCHEMBL1344257 | 0.80 | SLC6A4 (0.37) | SLC6A4HSD17B10KMT2AMEN1KDM4E |
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-4257549-A | — | — | None | — | — | JP | disclosed |
| JP-H04257549-A | CATALYTIC PRODUCTION OF N,N,N-TRISUBSTITUTED NITROGEN-CONTAINING COMPOUND | UNION CARBIDE CHEM & PLAST CO INC | 1992-09-11 | — | — | JP | disclosed |