Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.68 |
| ▸ | CA2 | P00918 | 5/20 | 0.64 |
| ▸ | CA1 | P00915 | 4/20 | 0.64 |
| ▸ | MAPT | P10636 | 2/20 | 0.64 |
| ▸ | CA12 | O43570 | 2/20 | 0.64 |
| ▸ | CA4 | P22748 | 2/20 | 0.64 |
| ▸ | CA6 | P23280 | 2/20 | 0.64 |
| ▸ | CA7 | P43166 | 2/20 | 0.64 |
| ▸ | CA9 | Q16790 | 2/20 | 0.64 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.64 |
| ▸ | GAA | P10253 | 1/20 | 0.64 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.64 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.64 |
| ▸ | TTR | P02766 | 2/20 | 0.58 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.55 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.55 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29524547 | 1.00 | TSHR (0.68) | TSHRCA2CA1MAPTCA12 | |
| SCHEMBL184485 | 1.00 | TSHR (0.68) | TSHRCA2CA1MAPTCA12 | |
| Water SCHEMBL1984245 | 0.98 | TSHR (0.65) | TSHRCA2CA1MAPTCA12 | |
| Water SCHEMBL1984247 | 0.98 | TSHR (0.65) | TSHRCA2CA1MAPTCA12 | |
| Hydrochloric Acid SCHEMBL11158583 | 0.98 | TSHR (0.65) | TSHRCA2CA1MAPTCA12 | |
| Hydrazine SCHEMBL27542387 | 0.96 | TSHR (0.63) | TSHRCA2CA1MAPTCA12 | |
| Cyclohexane SCHEMBL1356517 | 0.94 | TSHR (0.61) | TSHRCA2CA1MAPTCA12 | |
| Paraben SCHEMBL27501871 | 0.92 | CA2 (0.61) | TSHRCA2CA1MAPTCA12 | |
| Biphenyl SCHEMBL27517102 | 0.90 | ESR2 (0.63) | TSHRCA2CA1MAPTCA12 | |
| SCHEMBL2649763 | 0.89 | KDM4E (0.59) | TSHRCA2CA1MAPTCA12 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0994848-A1 | GLUCAGON ANTAGONISTS/INVERSE AGONISTS | NOVO NORDISK A/S (DK) | 2000-04-26 | — | — | EP | disclosed |
| WO-1999001423-A1 | GLUCAGON ANTAGONISTS/INVERSE AGONISTS | NOVO NORDISK A/S (DK) | 1999-01-14 | — | — | WO | disclosed |