Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | CA12 | O43570 | 2/20 | 0.51 |
| ▸ | CA1 | P00915 | 2/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | CA7 | P43166 | 2/20 | 0.51 |
| ▸ | CA9 | Q16790 | 2/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.42 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8698869 | 0.88 | CA12 (0.50) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL4755004 | 0.87 | CA12 (0.66) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL22032127 | 0.87 | CA12 (0.49) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL7844592 | 0.86 | TSHR (0.56) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL27993373 | 0.85 | ALDH1A1 (0.57) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL4001073 | 0.85 | ALDH1A1 (0.58) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL21396118 | 0.85 | ALDH1A1 (0.57) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL21052519 | 0.85 | MCL1 (0.57) | TSHRCA12CA1CA2CA7 | |
| SCHEMBL7535754 | 0.84 | TSHR (0.61) | TSHRALDH1A1HSD17B10LMNAL3MBTL1 | |
| SCHEMBL1515838 | 0.84 | ALDH1A1 (0.60) | TSHRCA12CA1CA2CA7 |
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-5482971-A | Beta3 -adrenergic agents and their use in pharmaceutical compositions | AMERICAN CYANAMID COMPANY (US) | 1996-01-09 | — | — | US | disclosed |