Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 6/20 | 0.44 |
| ▸ | MMP13 | P45452 | 5/20 | 0.44 |
| ▸ | MMP8 | P22894 | 4/20 | 0.44 |
| ▸ | MMP12 | P39900 | 4/20 | 0.44 |
| ▸ | MMP14 | P50281 | 4/20 | 0.44 |
| ▸ | MMP16 | P51512 | 4/20 | 0.44 |
| ▸ | MMP9 | P14780 | 5/20 | 0.42 |
| ▸ | MMP1 | P03956 | 4/20 | 0.42 |
| ▸ | MMP3 | P08254 | 3/20 | 0.42 |
| ▸ | THRA | P10827 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7256735 | 0.75 | PTGDR2 (0.47) | THRATHRBTSHRALDH1A1 | |
| SCHEMBL7256723 | 0.72 | CA5A (0.44) | THRATHRBPTGS1AKR1C3AKR1C2 | |
| SCHEMBL5126381 | 0.71 | MMP2 (0.56) | MMP2MMP13MMP8MMP12MMP14 | |
| SCHEMBL7350727 | 0.70 | NR3C1 (0.46) | THRATHRBTSHRALDH1A1 | |
| SCHEMBL7260747 | 0.70 | THRB (0.49) | THRATHRBLMNACA12CA1 | |
| SCHEMBL7256754 | 0.70 | THRB (0.51) | THRATHRBCA12CA1CA9 | |
| SCHEMBL5859452 | 0.69 | THRB (0.62) | THRATHRBPTGS1AKR1C3AKR1C2 | |
| SCHEMBL5130096 | 0.67 | MMP2 (0.48) | MMP2MMP13MMP8MMP12MMP14 | |
| SCHEMBL14033272 | 0.67 | MMP2 (0.50) | MMP2MMP13MMP8MMP12MMP14 | |
| SCHEMBL5132624 | 0.67 | MMP2 (0.53) | MMP2MMP13MMP8MMP12MMP14 |
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-6646005-B1 | Administering nontoxic sulfur compounds such as 3,5-dibromo-4-(4-hydroxy-3-iodophenylsulfonyl)phenylacetic acid, having side effect reduction; alopecia | THE UNIVERSITY OF TEXAS SOUTHWESTERN MEDICAL CENTER | 2003-11-11 | — | — | US | disclosed |