Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.57 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.46 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | SI | P14410 | 1/20 | 0.40 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL125808 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL30288135 | 0.95 | TSHR (0.57) | TSHRCA1CA12CA14SLC1A1 | |
| Hydrochloric Acid SCHEMBL30807127 | 0.95 | TSHR (0.57) | TSHRCA1CA12CA14SLC1A1 | |
| SCHEMBL27652882 | 0.89 | TSHR (0.50) | TSHRCA1CA12CA14SLC1A1 | |
| SCHEMBL130826 | 0.83 | TSHR (0.64) | TSHRCA1CA12CA14SLC1A1 | |
| SCHEMBL3959521 | 0.81 | TSHR (0.46) | TSHRCA1CA12CA14SLC1A1 | |
| Ammonia Solution, Strong SCHEMBL28141138 | 0.81 | TSHR (0.52) | TSHRCA12CA14SLC1A1CA7 | |
| SCHEMBL995832 | 0.81 | TSHR (0.61) | TSHRCA12CA14CA7CA9 | |
| SCHEMBL11949385 | 0.81 | BLM (0.52) | TSHRCA1CA12CA14SLC1A1 | |
| SCHEMBL11949396 | 0.81 | BLM (0.52) | TSHRCA1CA12CA14SLC1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0360222-B1 | PROCESS FOR PREPARING GAMMA-BUTYROBETAINE | LONZA AG (CH) | 1993-03-10 | — | — | EP | claimed |