Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 4/20 | 0.33 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 4/20 | 0.31 |
| ▸ | CA2 | P00918 | 4/20 | 0.31 |
| ▸ | MMP2 | P08253 | 2/20 | 0.31 |
| ▸ | MMP9 | P14780 | 2/20 | 0.31 |
| ▸ | CA12 | O43570 | 2/20 | 0.31 |
| ▸ | CA9 | Q16790 | 2/20 | 0.31 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | MMP3 | P08254 | 1/20 | 0.31 |
| ▸ | MMP8 | P22894 | 1/20 | 0.31 |
| ▸ | MMP13 | P45452 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 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 | |
|---|---|---|---|---|
| SCHEMBL1031355 | 1.00 | THRB (0.43) | THRBMEN1KMT2AGRM5GRM1 | |
| SCHEMBL1031356 | 1.00 | THRB (0.43) | THRBMEN1KMT2AGRM5GRM1 | |
| SCHEMBL1031354 | 1.00 | THRB (0.43) | THRBMEN1KMT2AGRM5GRM1 | |
| SCHEMBL1920420 | 0.95 | THRB (0.36) | THRBMEN1KMT2AGRM5GRM1 | |
| SCHEMBL1920419 | 0.95 | THRB (0.36) | THRBMEN1KMT2AGRM5GRM1 | |
| SCHEMBL524807 | 0.95 | THRB (0.36) | THRBMEN1KMT2AGRM5GRM1 | |
| Heptane SCHEMBL28774909 | 0.84 | NAAA (0.40) | EPHX1 | |
| SCHEMBL27769894 | 0.81 | TSHR (0.38) | GRM5GRM1CA1CA2CA12 | |
| Sulfuric Acid SCHEMBL10598950 | 0.78 | THRB (0.62) | THRBMEN1KMT2ACA1CA2 | |
| Sulfuric Acid SCHEMBL3383145 | 0.78 | THRB (0.62) | THRBMEN1KMT2ACA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101337914-B | Preparation method of taurine and substituted taurine | UNIV BEIJING CHEMICAL | 2012-04-04 | — | — | CN | disclosed |
| CN-101337914-A | Method for preparing taurine and substituted taurine | UNIV BEIJING CHEMICAL (CN) | 2009-01-07 | — | — | CN | disclosed |