Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | AGXT | P21549 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL2128784 | 0.79 | TSHR (0.52) | TSHRIDO1AGXTALDH1A1SLC6A2 | |
| SCHEMBL51153 | 0.79 | TSHR (0.52) | TSHRIDO1AGXTALDH1A1SLC6A2 | |
| SCHEMBL20776659 | 0.79 | TSHR (0.43) | TSHRIDO1AGXTALDH1A1SLC6A2 | |
| SCHEMBL11444701 | 0.77 | TSHR (0.50) | TSHRIDO1AGXTALDH1A1SLC6A2 | |
| SCHEMBL11444625 | 0.77 | TSHR (0.50) | TSHRIDO1AGXTALDH1A1SLC6A2 | |
| SCHEMBL28006880 | 0.77 | TSHR (0.50) | TSHRIDO1AGXTALDH1A1SLC6A2 | |
| SCHEMBL15021274 | 0.77 | TSHR (0.50) | TSHRIDO1AGXTALDH1A1SLC6A2 | |
| Hydrochloric Acid SCHEMBL27474797 | 0.77 | TSHR (0.50) | TSHRIDO1AGXTALDH1A1SLC6A2 | |
| SCHEMBL11700510 | 0.76 | ALDH1A1 (0.41) | TSHRALDH1A1SLC6A2SLC6A3LMNA | |
| SCHEMBL5178293 | 0.76 | TSHR (0.48) | TSHRIDO1AGXTALDH1A1SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5863536-A | N-ACETYLATED ALPHA-LINKED ACIDIC DIPEPTIDASE (NAALADASE) ENZYME INHIBITOR FOR THE TREATMENT OF GLUTAMATE ABNORMALITIES AND ASSOCIATED NERVOUS TISSUE ISCHEMIA IN A ANIMAL AND FOR TREATMENT OF PROSTATE DISEASE | GUILFORD PHARMACEUTICALS INC. (US) | 1999-01-26 | — | — | US | disclosed |
| US-5795877-A | Inhibitors of NAALADase enzyme activity | GUILFORD PHARMACEUTICALS INC. (US) | 1998-08-18 | — | — | US | disclosed |