Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | GBA1 | P04062 | 1/20 | 0.51 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.51 |
| ▸ | MMP9 | P14780 | 2/20 | 0.48 |
| ▸ | MMP13 | P45452 | 2/20 | 0.48 |
| ▸ | MMP8 | P22894 | 1/20 | 0.48 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.48 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.47 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.47 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | MMP1 | P03956 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9485564 | 0.81 | ALDH1A1 (0.65) | ALDH1A1TSHRGBA1MMP9MMP13 | |
| SCHEMBL10332270 | 0.80 | ALDH1A1 (0.67) | ALDH1A1TSHRGBA1CA2CA9 | |
| SCHEMBL255603 | 0.79 | MMP9 (0.74) | MMP9MMP13MMP8ADAMTS4SLC1A3 | |
| Hydrochloric Acid SCHEMBL8567011 | 0.79 | SLC1A3 (0.57) | ALDH1A1TSHRGBA1TBXAS1MMP9 | |
| SCHEMBL697840 | 0.79 | MMP9 (0.74) | MMP9MMP13MMP8ADAMTS4SLC1A3 | |
| SCHEMBL5182861 | 0.79 | MMP9 (0.74) | MMP9MMP13MMP8ADAMTS4SLC1A3 | |
| SCHEMBL29186820 | 0.78 | MMP9 (0.72) | MMP9MMP13MMP8ADAMTS4SLC1A3 | |
| SCHEMBL28937664 | 0.78 | MMP9 (0.72) | MMP9MMP13MMP8ADAMTS4SLC1A3 | |
| Water SCHEMBL30893957 | 0.78 | MMP9 (0.72) | MMP9MMP13MMP8ADAMTS4SLC1A3 | |
| SCHEMBL24130567 | 0.77 | ALDH1A1 (0.63) | ALDH1A1TSHRGBA1MMP9MMP13 |
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-4933470-A | Method of synthesis of vicinal diamines | NEORX CORPORATION (US) | 1990-06-12 | — | — | US | disclosed |